Diethyl Ether--boron Trifluoride
fo-fdbbd0936ba650f2
Identity
- Type
- Molecular complex
- CAS
- 109-63-7
- EC
- 203-689-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
43- (Diethyl ether)trifluoroborane
- (Diethyl ether)trifluoroboron
- (T-4)-Trifluoro[1,1′-oxybis[ethane]]boron
- Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)
- Boron fluoride (BF3), compd. with ethyl ether (1:1)
- Boron fluoride (BF3)-ethyl ether compound
- Boron fluoride diethyl ether complex
- Boron fluoride diethyl etherate
- Boron fluoride etherate
- Boron fluoride monoetherate
- Boron fluoride-diethyl ether compound
- Boron fluoride-ethyl ether complex
- Boron fluoride-ethyl etherate
- Boron trifluoride diethyl ether adduct
- Boron trifluoride etherate
- Boron trifluoride etherate (1:1)
- Boron trifluoride ethyl etherate (1:1)
- Boron trifluoride monoetherate
- Boron trifluoride-diethyl ether (1:1)
- Boron trifluoride-diethyl ether 1:1 complex
- Boron trifluoride-diethyl ether complex
- Boron trifluoride-diethyl ether complex (1:1)
- Boron trifluoride-diethyl etherate
- Boron trifluoride-ether complex
- Boron trifluoride-ethyl ether
- Boron trifluoride-ethyl ether (1:1)
- Boron trifluoride-ethyl ether complex
- Boron trifluoride-ethyl etherate
- Boron, trifluoro[1,1′-oxybis[ethane]]-, (T-4)-
- Diethyl ether compound with boron trifluoride
- Diethyl ether trifluoroborane complex
- Diethyl ether-trifluoroborane (1:1)
- Ethane, 1,1′-oxybis-, compd. with trifluoroborane (1:1)
- Ethyl ether, compd. with BF3 (1:1)
- Ethyl ether, compd. with boron fluoride (BF3) (1:1)
- Ethyl ether-boron trifluoride complex
- Trifluoro(diethyl ether)boron
- Trifluoro[1,1′-oxybis[ethane]]boron
- Trifluoroborane diethyl ether complex
- Trifluoroborane diethyl etherate
- Trifluoroborane-1,1′-oxybis[ethane] (1:1)
- Trifluoroboron etherate
- Trifluoroboron-diethyl ether (1:1)
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | KZMGYPLQYOPHEL-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C4H10O.BF3/c1-3-5-4-2;2-1(3)4/h3-4H2,1-2H3; |
| IUPAC name chemrof:IUPAC_name | Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1) |
| Molecular formula chemrof:molecular_formula | C4H10BF3O |
| Molecular mass chemrof:molecular_mass | 141.929 |
| Monoisotopic mass chemrof:monoisotopic_mass | 142.07768 |
| SMILES string chemrof:smiles_string | CCOCC.FB(F)F |
Known URLs
7Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=109-63-7 | enrich_references.consensus_cas_link |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID40861733 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1710835 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/422VHH19IT | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.250.530B | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/517922 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q10866254 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 5b65d05f-db00-43bd-9051-9b5d1bbed895 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| ca30d1c1-bf97-434d-8b22-07f8bdc8cbe5 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 506b1f1b-5caf-47ac-a602-ab237bb2bb98 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 89ba54a4-837a-4e4f-b0b5-93aad6655a79 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ddfc7f2a-7f57-401b-9abc-807da6bc953e | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 89860f00-85ad-45d6-9a5f-c7b4812bfc78 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 99d440d6-7105-4213-8d5a-eb5aac749686 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| efdd4e45-d100-4144-9b87-890c4cba1b4d | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 68f7b470-e2f1-42af-ba8d-a46432edd2e5 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 1dfaa015-4a9e-4caf-a2f7-f89b5eca19f0 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 36325732-4279-4526-8df5-742d928be175 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 3db7959e-59c7-4cb8-bf9a-0e263488dc38 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 7cd7067f-bbd9-4d49-96b8-b9908f8d2e8c | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-fdbbd0936ba650f2",
"prefLabel": [
{
"@value": "Diethyl Ether--boron Trifluoride",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "(Diethyl ether)trifluoroborane",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "(Diethyl ether)trifluoroboron",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "(T-4)-Trifluoro[1,1′-oxybis[ethane]]boron",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride (BF3), compd. with ethyl ether (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride (BF3)-ethyl ether compound",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride diethyl ether complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride diethyl etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride monoetherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride-diethyl ether compound",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride-ethyl ether complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron fluoride-ethyl etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride diethyl ether adduct",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride etherate (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride ethyl etherate (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride monoetherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-diethyl ether (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-diethyl ether 1:1 complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-diethyl ether complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-diethyl ether complex (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-diethyl etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-ether complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-ethyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-ethyl ether (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-ethyl ether complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron trifluoride-ethyl etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Boron, trifluoro[1,1′-oxybis[ethane]]-, (T-4)-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diethyl ether compound with boron trifluoride",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diethyl ether trifluoroborane complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diethyl ether-trifluoroborane (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethane, 1,1′-oxybis-, compd. with trifluoroborane (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethyl ether, compd. with BF3 (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethyl ether, compd. with boron fluoride (BF3) (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethyl ether-boron trifluoride complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoro(diethyl ether)boron",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoro[1,1′-oxybis[ethane]]boron",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoroborane diethyl ether complex",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoroborane diethyl etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoroborane-1,1′-oxybis[ethane] (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoroboron etherate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Trifluoroboron-diethyl ether (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:109-63-7",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C4H10BF3O"
],
"attested_by": {
"C4H10BF3O": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCOCC.FB(F)F"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"KZMGYPLQYOPHEL-UHFFFAOYSA-N"
],
"attested_by": {
"KZMGYPLQYOPHEL-UHFFFAOYSA-N": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCOCC.FB(F)F"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"CCOCC.FB(F)F"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCOCC.FB(F)F"
]
}
],
"attested_by": {
"CCOCC.FB(F)F": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C4H10O.BF3/c1-3-5-4-2;2-1(3)4/h3-4H2,1-2H3;"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCOCC.FB(F)F"
]
}
],
"attested_by": {
"InChI=1S/C4H10O.BF3/c1-3-5-4-2;2-1(3)4/h3-4H2,1-2H3;": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)"
]
},
"attested_by": {
"Borane, trifluoro-, compd. with 1,1′-oxybis[ethane] (1:1)": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
141.929
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"B(F)(F)F.CCOCC"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCOCC.FB(F)F"
]
}
],
"attested_by": {
"141.929": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
142.07768
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"B(F)(F)F.CCOCC"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCOCC.FB(F)F"
]
}
],
"attested_by": {
"142.07768": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.250.530B",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922;CAS:109-63-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[109-63-7]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=109-63-7",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"109-63-7"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID40861733",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922;CAS:109-63-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[109-63-7]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/422VHH19IT",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922;CAS:109-63-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[109-63-7]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/517922",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922;CAS:109-63-7"
],
"prov:wasDerivedFrom": "pubchem.by_cas[109-63-7]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1710835",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922;CAS:109-63-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[109-63-7]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q10866254",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:517922;CAS:109-63-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[109-63-7]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1dfaa015-4a9e-4caf-a2f7-f89b5eca19f0",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "multi_component_neutral",
"reason": "",
"types": [
"https://w3id.org/chemrof/MolecularComplex"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.multi_component_neutral"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"109-63-7"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=109-63-7"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"203-689-8"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=203-689-8"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/MolecularComplex"
]
}
Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works