4,4'-(oxydiethane-2,1-diyl)dimorpholine
fo-333412768d8618b3
Identity
- Type
- Neutral molecule
- CAS
- 6425-39-4
- EC
- 229-194-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
25- 2,2′-Dimorpholinodiethyl ether
- 2,2′-Dimorpholinyldiethyl ether
- 4,4′-(Oxydi-2,1-ethanediyl)bis[morpholine]
- 4,4′-(Oxydi-2,1-ethanediyl)bismorpholine
- 4,4′-(Oxydiethylene)bis[morpholine]
- 4,4′-(Oxydiethylene)dimorpholine
- B 802012
- Bis(2-morpholinoethyl) ether
- Bis(morpholinoethyl) ether
- Bis[2-(4-morpholino)ethyl] ether
- Dabco DMDEE
- Di(2-morpholinoethyl) ether
- Dimorpholinodiethyl ether
- DMDEE
- JD-DMDEE
- Jeffcat DMDEE
- Jeffcat DMDLS
- Lupragen N 106
- Maycat DMDEE
- Morpholine, 4,4′-(oxydi-2,1-ethanediyl)bis-
- Morpholine, 4,4′-(oxydiethylene)di-
- PC CAT DMDEE
- Texacat DMDEE
- U-CAT 660M
- β,β′-Dimorpholinodiethyl ether
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | ZMSQJSMSLXVTKN-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2 |
| IUPAC name chemrof:IUPAC_name | 4,4'-(oxydiethane-2,1-diyl)dimorpholine |
| Molecular formula chemrof:molecular_formula | C12H24N2O3 |
| Molecular mass chemrof:molecular_mass | 244.335 |
| Monoisotopic mass chemrof:monoisotopic_mass | 244.178693 |
| SMILES string chemrof:smiles_string | C1CN(CCOCCN2CCOCC2)CCO1 |
Known URLs
11Where 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=6425-39-4 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.026.540 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9042170 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=28749 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3187951 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5BH27U8GG4 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.649.988I | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J207.041C | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/80900 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q21034660 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/DMDEE | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 14a73e0c-1897-4b44-9958-b55fa3940903 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 4e8a12d2-52b7-4de1-a20b-c5c760942f0b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 3eb3f001-e501-4385-97dd-8b4662a6fe71 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 3293a6c2-931f-440b-8871-57cb40ec16f5 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| f937c2a2-bed8-4099-b081-60e06628d000 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| b372fe85-3a10-41ec-8d44-d9b0064a42bd | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| b097bd2d-de99-4b70-8b96-9a60c991cea2 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| fa9ba380-f806-4349-9df8-7a2a9e0ad3fc | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 3a49ed3c-e90c-41ca-b6d3-100961585fb5 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 3ab78980-d460-4f30-83b1-d5e8456f4ef5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 74a09adb-e3f3-4c32-bcc3-0e693dbed5a5 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| e1d592a6-080f-4d0d-884d-190bb4059bd3 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 3bc32395-ca55-4d93-b601-435012790bf0 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (54 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-333412768d8618b3",
"prefLabel": [
{
"@value": "4,4'-(oxydiethane-2,1-diyl)dimorpholine",
"@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": "2,2′-Dimorpholinodiethyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2′-Dimorpholinyldiethyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4,4′-(Oxydi-2,1-ethanediyl)bis[morpholine]",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4,4′-(Oxydi-2,1-ethanediyl)bismorpholine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4,4′-(Oxydiethylene)bis[morpholine]",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4,4′-(Oxydiethylene)dimorpholine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "B 802012",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Bis(2-morpholinoethyl) ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Bis(morpholinoethyl) ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Bis[2-(4-morpholino)ethyl] ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dabco DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Di(2-morpholinoethyl) ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dimorpholinodiethyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "JD-DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Jeffcat DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Jeffcat DMDLS",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Lupragen N 106",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Maycat DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Morpholine, 4,4′-(oxydi-2,1-ethanediyl)bis-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Morpholine, 4,4′-(oxydiethylene)di-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "PC CAT DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Texacat DMDEE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "U-CAT 660M",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "β,β′-Dimorpholinodiethyl ether",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:6425-39-4",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C12H24N2O3"
],
"attested_by": {
"C12H24N2O3": [
"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:80900"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1CN(CCOCCN2CCOCC2)CCO1"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"ZMSQJSMSLXVTKN-UHFFFAOYSA-N"
],
"attested_by": {
"ZMSQJSMSLXVTKN-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:80900"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1CN(CCOCCN2CCOCC2)CCO1"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"C1CN(CCOCCN2CCOCC2)CCO1"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"4,4'-(oxydiethane-2,1-diyl)dimorpholine"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1CN(CCOCCN2CCOCC2)CCO1"
]
}
],
"attested_by": {
"C1CN(CCOCCN2CCOCC2)CCO1": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"4,4'-(oxydiethane-2,1-diyl)dimorpholine"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1CN(CCOCCN2CCOCC2)CCO1"
]
}
],
"attested_by": {
"InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"4,4'-(oxydiethane-2,1-diyl)dimorpholine"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"4,4'-(oxydiethane-2,1-diyl)dimorpholine"
]
},
"attested_by": {
"4,4'-(oxydiethane-2,1-diyl)dimorpholine": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
244.335
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1COCCN1CCOCCN2CCOCC2"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1CN(CCOCCN2CCOCC2)CCO1"
]
}
],
"attested_by": {
"244.335": [
"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": [
244.178693
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1COCCN1CCOCCN2CCOCC2"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1CN(CCOCCN2CCOCC2)CCO1"
]
}
],
"attested_by": {
"244.178693": [
"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=J1.649.988I",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J207.041C",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.026.540",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=6425-39-4",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"6425-39-4"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID9042170",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=28749",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://en.wikipedia.org/wiki/DMDEE",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5BH27U8GG4",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/80900",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.by_cas[6425-39-4]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3187951",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q21034660",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:80900;CAS:6425-39-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[6425-39-4]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "14a73e0c-1897-4b44-9958-b55fa3940903",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "neutral_molecule",
"reason": "",
"types": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"6425-39-4"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=6425-39-4"
}
],
"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": [
"229-194-7"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=229-194-7"
],
"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/NeutralMolecule"
]
}
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