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 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C3H3NO2 Net Charge 0 Average Mass 85.06146 Monoisotopic Mass 85.01638 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 Type Source 21247203 PubMed citation Europe PMC Last Modified 10 January 2012