Antipyrine
fo-05d1c9ed91da5039
Identity
- Type
- Neutral molecule
- CAS
- 60-80-0
- EC
- 200-486-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 60 across every transformer
Structure
What it is used for
1
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| environmental contaminant CHEBI:78298 | Any minor or unwanted substance introduced into the environment that can have undesired effects. | ChEBI |
Alternative labels
36- 1,2-Dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one
- 1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
- 1,5-Dimethyl-2-phenyl-1,2-dihydropyrazol-3-one
- 1,5-Dimethyl-2-phenyl-1H-pyrazol-3(2H)-one
- 1,5-Dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one
- 1,5-Dimethyl-2-phenylpyrazol-3-one
- 1-Phenyl-2,3-dimethyl-5-pyrazolone
- 2,3-Dimethyl-1-phenyl-3-pyrazolin-5-one
- 2,3-Dimethyl-1-phenyl-5-pyrazolone
- 3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-2-phenyl-
- Analgesin
- Analgesine
- Anodynin
- Anodynine
- Antipirin
- Antipyrin
- Apirelina
- Azophen
- Azophene
- Dentigoa N
- Dimethyloxychinizin
- Dimethyloxyquinazine
- Eu-Med mono
- fenazona
- Fenazone
- MeSH ID: D000983
- Methozin
- Oxydimethylquinazine
- Parodyne
- Phenazone (pharmaceutical)
- phenazonum
- Phenylon
- Phenylone
- Pyrazophyl
- Sedatin
- Sedatine
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | VEQOALNAAJBPNY-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3 |
| IUPAC name chemrof:IUPAC_name | 1,2-Dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one |
| Molecular formula chemrof:molecular_formula | C11H12N2O |
| Molecular mass chemrof:molecular_mass | 188.23 |
| Monoisotopic mass chemrof:monoisotopic_mass | 188.09496, 188.094963 |
| SMILES string chemrof:smiles_string | Cc1cc(=O)n(-c2ccccc2)n1C |
Known URLs
38Where 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=60-80-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:31225 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.000.442 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0376 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6021117 | enrich_references.pubchem_identifier_url |
| DrugBank | https://go.drugbank.com/drugs/DB01435 | enrich_references.chebi_xrefs |
| drugbank.ca | https://www.drugbank.ca/drugs/DB01435 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:861 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/861 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=755874 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7945 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL277474 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/T3CHA1B51H | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0015503 | enrich_references.chebi_xrefs |
| hts.usitc.gov | https://hts.usitc.gov/search?query=2933.11.00.00 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.340J | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C13244 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D01776 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C13244 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D01776 | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-3038 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=43561 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C76794 | enrich_references.pubchem_identifier_url |
| pharmgkb.org | https://www.pharmgkb.org/chemical/PA448453 | enrich_references.pubchem_identifier_url |
| pharos.nih.gov | https://pharos.nih.gov/ligands/7WY76MHB5MMB | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL277474 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/2206 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=020293 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24345239 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25038548 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25435228 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25631541 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26703262 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/3425858 | enrich_references.chebi_xrefs |
| reaxys | reaxys:157775 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q415578 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Antipyrine | enrich_references.chebi_xrefs |
| Wikipedia | https://en.wikipedia.org/wiki/Phenazone | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| d86c88d9-6555-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-966c-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 6 |
| 17bfc019-94e5-410f-9c8c-8b4872a89245 | Environmental → Air → Indoor | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-966b-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4d9a8790-3ddd-11dd-966d-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-966a-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-9668-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-9671-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-9669-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-966f-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 4d9a8790-3ddd-11dd-9672-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-966e-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 6 |
| 4d9a8790-3ddd-11dd-9670-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 6 |
History
Everything that changed this substance (60 changes)
Full record
Flow object JSON
{
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{
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{
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{
"@value": "3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-2-phenyl-",
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},
{
"@value": "Analgesin",
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},
{
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}
},
{
"@value": "Anodynin",
"@language": "en",
"@lang": "en",
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},
{
"@value": "Anodynine",
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}
},
{
"@value": "Antipirin",
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},
{
"@value": "Antipyrin",
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}
},
{
"@value": "Apirelina",
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}
},
{
"@value": "Azophen",
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Azophene",
"@language": "en",
"@lang": "en",
"provenance": {
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],
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}
},
{
"@value": "Dentigoa N",
"@language": "en",
"@lang": "en",
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],
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}
},
{
"@value": "Dimethyloxychinizin",
"@language": "en",
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"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dimethyloxyquinazine",
"@language": "en",
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}
},
{
"@value": "Eu-Med mono",
"@language": "en",
"@lang": "en",
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "fenazona",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
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],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Fenazone",
"@language": "en",
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}
},
{
"@value": "MeSH ID: D000983",
"@language": "en",
"@lang": "en",
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Methozin",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Oxydimethylquinazine",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Parodyne",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Phenazone (pharmaceutical)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=60-80-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "phenazonum",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
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}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