CHEBI:51937 - butyronitrile

Main ChEBI Ontology Automatic Xrefs
ChEBI Name butyronitrile
ChEBI ID CHEBI:51937
Definition A nitrile that is hydrogen cyanide in which the hydrogen has been replaced by a propyl group.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C4H7N
Net Charge 0
Average Mass 69.10512
InChI InChI=1S/C4H7N/c1-2-3-4-5/h2-3H2,1H3
InChIKey KVNRLNFWIYMESJ-UHFFFAOYSA-N
SMILES CCCC#N
ChEBI Ontology
Outgoing butyronitrile (CHEBI:51937) is a nitrile (CHEBI:18379)
Incoming 2-(4-fluorophenyl)-3-oxobutyronitrile (CHEBI:51858) has functional parent butyronitrile (CHEBI:51937)
IUPAC Name
butanenitrile
Synonyms Sources
1-Cyanopropane ChemIDplus
Butyric acid nitrile ChemIDplus
n-Butanitrile NIST Chemistry WebBook
n-butyronitrile ChEBI
n-propyl cyanide ChEBI
propyl cyanide ChEBI
Database Links Databases
Butyronitrile Wikipedia
CPD-12327 MetaCyc
View more database links
Registry Numbers Types Sources
109-74-0 CAS Registry Number NIST Chemistry WebBook
109-74-0 CAS Registry Number ChemIDplus
1361452 Reaxys Registry Number Reaxys
1361452 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
21702510 PubMed citation CiteXplore
23919523 PubMed citation CiteXplore
24533637 PubMed citation CiteXplore
Last Modified
24 Февраль 2014