CHEBI:51889 - cyanoacetic acid

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ChEBI Name cyanoacetic acid
ChEBI ID CHEBI:51889
Definition A monocarboxylic acid that consists of acetic acid bearing a cyano substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C3H3NO2
Net Charge 0
Average Mass 85.06146
Monoisotopic Mass 85.016
InChI InChI=1S/C3H3NO2/c4-2-1-3(5)6/h1H2,(H,5,6)
InChIKey MLIREBYILWEBDM-UHFFFAOYSA-N
SMILES OC(=O)CC#N
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cyanoacetic acid (CHEBI:51889) has functional parent acetic acid (CHEBI:15366)
cyanoacetic acid (CHEBI:51889) is a monocarboxylic acid (CHEBI:25384)
Incoming cyanoacetate ester (CHEBI:51888) has functional parent cyanoacetic acid (CHEBI:51889)
IUPAC Name
cyanoacetic acid
Synonyms Sources
Acide cyanacetique ChemIDplus
Cyanessigsäure ChemIDplus
cyanoethanoic acid ChEBI
Malonic acid mononitrile ChemIDplus
Malonic mononitrile ChemIDplus
Registry Numbers Types Sources
372-09-8 CAS Registry Number NIST Chemistry WebBook
372-09-8 CAS Registry Number ChemIDplus
506325 Beilstein Registry Number Beilstein
506325 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21247203 PubMed citation Europe PMC
Last Modified
10 January 2012