Methyl 4-pyridyl Ketone

1-(4-Pyridinyl)ethanone
1-(4-Pyridyl)ethanone
1-(Pyridin-4-yl)ethan-1-one
1-(Pyridin-4-yl)ethanone
4-Acetylpyridine
4-Pyridinyl methyl ketone
4-Pyridyl methyl ketone
4-Pyridylethanone
Ethanone, 1-(4-pyridinyl)-
Ketone, methyl 4-pyridyl
Methyl pyridin-4-yl ketone
γ-Acetylpyridine

Property	Value
InChI2D key string chemrof:inchi2d_key_string	WMQUKDQWMMOHSA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C7H7NO/c1-6(9)7-2-4-8-5-3-7/h2-5H,1H3
IUPAC name chemrof:IUPAC_name	Methyl 4-pyridyl Ketone
Molecular formula chemrof:molecular_formula	C7H7NO
Molecular mass chemrof:molecular_mass	121.139
Monoisotopic mass chemrof:monoisotopic_mass	121.052764
SMILES string chemrof:smiles_string	CC(=O)c1ccncc1

Where 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=1122-54-9	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.013.047	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID0022147	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=111	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL445953	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/G47437IOW7	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J41.571E	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/14282	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#2810	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q27278737	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
e01b0aab-a7ef-462f-9968-89ac9d8b3427	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
e2d2fc60-7883-4cbb-9cd5-49d3b55e1dd3	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
955ee534-19b2-4d90-8605-b386eda20d69	Environmental → Air → Indoor	EF 3.1	kg	2
2edd9f61-a72b-4816-8ac4-2d88325b44da	Environmental → Air → Long-term	EF 3.1	kg	0
240baf2f-13c5-4082-86d6-c023aad1a036	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
245af252-f2f0-4f9b-89a6-981f95a16c03	Environmental → Air → Unknown	EF 3.1	kg	2
d067e38c-b2bd-4d31-8f25-020b15e2beef	Environmental → Ground → Agricultural	EF 3.1	kg	2
12b8563d-910b-469d-b107-e3d136ebaa33	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
eeaeb62a-1e8f-4315-b832-632ecdce4748	Environmental → Ground → Unknown	EF 3.1	kg	2
79780946-950e-4eb5-bbc8-15a6f13c3cf1	Environmental → Water → Long-term	EF 3.1	kg	0
e2b27fa9-729d-4f5f-915b-3308353f5439	Environmental → Water → Ocean	EF 3.1	kg	2
0bb0fc11-a5dc-48fe-a2cc-b3bc57048b6e	Environmental → Water → Surface water	EF 3.1	kg	2
9aba9deb-aba3-47cb-937c-6794a422cebb	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

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      ],
      "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"
  ]
}

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

Methyl 4-pyridyl Ketone

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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