N-vinylformamide
fo-1cffc405a12072fa
Identity
- Type
- Neutral molecule
- CAS
- 13162-05-5
- EC
- 236-102-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
5- Formamide, N-ethenyl-
- Formamide, N-vinyl-
- N-Ethenylformamide
- NVF-P
- NVF-TM
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | ZQXSMRAEXCEDJD-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C3H5NO/c1-2-4-3-5/h2-3H,1H2,(H,4,5) |
| IUPAC name chemrof:IUPAC_name | N-vinylformamide |
| Molecular formula chemrof:molecular_formula | C3H5NO |
| Molecular mass chemrof:molecular_mass | 71.079 |
| Monoisotopic mass chemrof:monoisotopic_mass | 71.037114 |
| SMILES string chemrof:smiles_string | C=CNC=O |
Known URLs
8Where 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=13162-05-5 | enrich_references.consensus_cas_link |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=72018-12-3 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.032.806 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9065366 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/14540119E3 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J111.250C | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/83191 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q1959616 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 673f4fc4-e808-4ac4-9f04-fdcc078a9ee0 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| cc558e08-5bc3-4880-9e11-aae85c20711b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 54c4f489-9f77-4b39-a549-597239b07306 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 1dd26984-0c1e-41d6-ad98-64ec611a4e00 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 5997969f-f459-4517-853e-c3445191ced7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| bb6b4ad5-7b1a-4020-b790-a9d4a2294ce0 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| dcabe0dd-8fcf-498c-aa5a-8934d9059f65 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| be5ada77-601d-47a6-adcb-e27e39e3430e | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 3db5cc4f-39f8-489b-9065-6ea153cdc919 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| da42a1c4-89c1-46de-a3de-245baf3fe174 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 81b45db5-e432-4a34-ad2b-f44dbc53a070 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| ce798eae-5d07-4209-b262-e651f1eb86b9 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| a33cce91-2a74-4052-bfe3-6477a8d82ca0 | 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-1cffc405a12072fa",
"prefLabel": [
{
"@value": "N-vinylformamide",
"@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": "Formamide, N-ethenyl-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:13162-05-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Formamide, N-vinyl-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:13162-05-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "N-Ethenylformamide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:13162-05-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "NVF-P",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:13162-05-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "NVF-TM",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:13162-05-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C3H5NO"
],
"attested_by": {
"C3H5NO": [
"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:83191"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"ZQXSMRAEXCEDJD-UHFFFAOYSA-N"
],
"attested_by": {
"ZQXSMRAEXCEDJD-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:83191"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"C=CNC=O"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N-vinylformamide"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
}
],
"attested_by": {
"C=CNC=O": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C3H5NO/c1-2-4-3-5/h2-3H,1H2,(H,4,5)"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N-vinylformamide"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
}
],
"attested_by": {
"InChI=1S/C3H5NO/c1-2-4-3-5/h2-3H,1H2,(H,4,5)": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"N-vinylformamide"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"N-vinylformamide"
]
},
"attested_by": {
"N-vinylformamide": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
71.079
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
}
],
"attested_by": {
"71.079": [
"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": [
71.037114
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C=CNC=O"
]
}
],
"attested_by": {
"71.037114": [
"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=J111.250C",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13162-05-5]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.032.806",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13162-05-5]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=13162-05-5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"13162-05-5"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=72018-12-3",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13162-05-5]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID9065366",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13162-05-5]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/14540119E3",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13162-05-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/83191",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[13162-05-5]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q1959616",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:83191;CAS:13162-05-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13162-05-5]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1dd26984-0c1e-41d6-ad98-64ec611a4e00",
"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": [
"13162-05-5"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=13162-05-5"
}
],
"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": [
"236-102-9"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=236-102-9"
],
"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