2-dimethylaminoethyl Methacrylate
fo-a3763f68a00b747c
Identity
- Type
- Neutral molecule
- CAS
- 2867-47-2
- EC
- 220-688-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
28- (2-Methacryloyloxyethyl)dimethylamine
- (Dimethylamino)ethyl methacrylate
- 2-(Dimethylamino)ethyl 2-methylprop-2-enoate
- 2-(Dimethylamino)ethyl methacrylate
- 2-(N,N-Dimethylamino)ethyl methacrylate
- 2-Dimethylaminoethyl 2-methylprop-2-enoate
- 2-Propenoic acid, 2-methyl-, 2-(dimethylamino)ethyl ester
- Acryester DM
- Ageflex FA 1
- Ageflex FM 1
- Ageflex FM 2
- CY-D 2 (monomethacrylate)
- Dimethyl[2-(methacryloyloxy)ethyl]amine
- DM (methacrylate)
- DMAEMA
- Light Ester DM
- MADAM
- Methacryl Ester DM
- Methacrylate DMA
- Methacrylic acid, 2-(dimethylamino)ethyl ester
- Methacryloyloxyethyldimethylamine
- Mhoromer BM 601
- N,N-Dimethylaminoethyl methacrylate
- N,N-Dimethylethanolamine methacrylate
- N,N′-Dimethylamino-2-ethyl methacrylate
- Visiomer MADAME
- β-(N,N-Dimethylamino)ethyl methacrylate
- β-Dimethylaminoethyl methacrylate
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | JKNCOURZONDCGV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H15NO2/c1-7(2)8(10)11-6-5-9(3)4/h1,5-6H2,2-4H3 |
| IUPAC name chemrof:IUPAC_name | 2-dimethylaminoethyl Methacrylate |
| Molecular formula chemrof:molecular_formula | C8H15NO2 |
| Molecular mass chemrof:molecular_mass | 157.213 |
| Monoisotopic mass chemrof:monoisotopic_mass | 157.110279 |
| SMILES string chemrof:smiles_string | C=C(C)C(=O)OCCN(C)C |
Known URLs
13Where 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=25154-86-3 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=2867-47-2 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.018.808 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0450 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1027504 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=20959 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1883484 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/O0V97PV2G1 | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0244940 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J48.651E | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/17869 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#2522 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q27285181 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 215a768f-8600-4431-a4d8-a549c4695714 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 7e6ac8fd-e354-429e-af90-0a32e3807aec | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 25c3d687-d6b3-4d0e-bec0-87ea19dc77a5 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 11b75b02-6ae8-4fbb-9f5d-12e4a0d1b996 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 527abf7b-7dc3-4ac6-acad-58a4280ea88a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| d2f924c2-5145-4bdd-a5b6-05d8fd322ba0 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 1875762f-a83b-41ed-9345-0b6f782f42ce | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| b28d3841-48fd-4737-a89d-9305f5e63579 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 78740b70-2319-4cbc-8d23-5c779dcded9a | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 815487ad-2935-4e59-bba2-3022c963e2fb | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 7609214b-22d0-471e-ac66-ec0a263f8766 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| b9910cf0-b860-4aaa-b012-a712b56fdd16 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| ed0a1e96-a73e-43c8-a3b0-a7cfddc4fdf7 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-a3763f68a00b747c",
"prefLabel": [
{
"@value": "2-dimethylaminoethyl Methacrylate",
"@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-Methacryloyloxyethyl)dimethylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "(Dimethylamino)ethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-(Dimethylamino)ethyl 2-methylprop-2-enoate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-(Dimethylamino)ethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-(N,N-Dimethylamino)ethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-Dimethylaminoethyl 2-methylprop-2-enoate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-Propenoic acid, 2-methyl-, 2-(dimethylamino)ethyl ester",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Acryester DM",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ageflex FA 1",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ageflex FM 1",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ageflex FM 2",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "CY-D 2 (monomethacrylate)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dimethyl[2-(methacryloyloxy)ethyl]amine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "DM (methacrylate)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "DMAEMA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Light Ester DM",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "MADAM",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methacryl Ester DM",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methacrylate DMA",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methacrylic acid, 2-(dimethylamino)ethyl ester",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methacryloyloxyethyldimethylamine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Mhoromer BM 601",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N-Dimethylaminoethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N-Dimethylethanolamine methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N,N′-Dimethylamino-2-ethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Visiomer MADAME",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "β-(N,N-Dimethylamino)ethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "β-Dimethylaminoethyl methacrylate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2867-47-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C8H15NO2"
],
"attested_by": {
"C8H15NO2": [
"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:17869"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=C(C)C(=O)OCCN(C)C"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"JKNCOURZONDCGV-UHFFFAOYSA-N"
],
"attested_by": {
"JKNCOURZONDCGV-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:17869"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=C(C)C(=O)OCCN(C)C"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"C=C(C)C(=O)OCCN(C)C"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2-dimethylaminoethyl Methacrylate"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=C(C)C(=O)OCCN(C)C"
]
}
],
"attested_by": {
"C=C(C)C(=O)OCCN(C)C": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C8H15NO2/c1-7(2)8(10)11-6-5-9(3)4/h1,5-6H2,2-4H3"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2-dimethylaminoethyl Methacrylate"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=C(C)C(=O)OCCN(C)C"
]
}
],
"attested_by": {
"InChI=1S/C8H15NO2/c1-7(2)8(10)11-6-5-9(3)4/h1,5-6H2,2-4H3": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"2-dimethylaminoethyl Methacrylate"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2-dimethylaminoethyl Methacrylate"
]
},
"attested_by": {
"2-dimethylaminoethyl Methacrylate": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
157.213
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC(=C)C(=O)OCCN(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=C(C)C(=O)OCCN(C)C"
]
}
],
"attested_by": {
"157.213": [
"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": [
157.110279
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC(=C)C(=O)OCCN(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=C(C)C(=O)OCCN(C)C"
]
}
],
"attested_by": {
"157.110279": [
"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=J48.651E",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.018.808",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0450",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=25154-86-3",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=2867-47-2",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2867-47-2"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID1027504",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=20959",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/O0V97PV2G1",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://hmdb.ca/metabolites/HMDB0244940",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/17869",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.by_cas[2867-47-2]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/erg/#2522",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1883484",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q27285181",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:17869;CAS:2867-47-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2867-47-2]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "11b75b02-6ae8-4fbb-9f5d-12e4a0d1b996",
"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": [
"2867-47-2"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=2867-47-2"
}
],
"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": [
"220-688-8"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=220-688-8"
],
"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/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