CHEBI:36432 - 2-methylbut-2-enoic acid

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ChEBI Name 2-methylbut-2-enoic acid
ChEBI ID CHEBI:36432
Definition A branched-chain fatty acid consisting of 2-butenoic acid having a methyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C5H8O2
Net Charge 0
Average Mass 100.11582
Monoisotopic Mass 100.05243
InChI InChI=1S/C5H8O2/c1-3-4(2)5(6)7/h3H,1-2H3,(H,6,7)
InChIKey UIERETOOQGIECD-UHFFFAOYSA-N
SMILES [H]C(C)=C(C)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-methylbut-2-enoic acid (CHEBI:36432) has functional parent 2-butenoic acid (CHEBI:17217)
2-methylbut-2-enoic acid (CHEBI:36432) has role metabolite (CHEBI:25212)
2-methylbut-2-enoic acid (CHEBI:36432) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
2-methylbut-2-enoic acid (CHEBI:36432) is a methyl-branched fatty acid (CHEBI:62499)
2-methylbut-2-enoic acid (CHEBI:36432) is a monounsaturated fatty acid (CHEBI:25413)
2-methylbut-2-enoic acid (CHEBI:36432) is a short-chain fatty acid (CHEBI:26666)
Incoming 2-methylbut-2-enoyl-coenzyme A (CHEBI:11614) has functional parent 2-methylbut-2-enoic acid (CHEBI:36432)
angelic acid (CHEBI:36431) is a 2-methylbut-2-enoic acid (CHEBI:36432)
heliosupine (CHEBI:5641) is a 2-methylbut-2-enoic acid (CHEBI:36432)
tiglic acid (CHEBI:9592) is a 2-methylbut-2-enoic acid (CHEBI:36432)
IUPAC Name
2-methylbut-2-enoic acid
Synonyms Sources
2,3-dimethylacrylic acid ChEBI
2-methyl-2-butenoic acid ChemIDplus
2-methylcrotonic acid ChEBI
α-methylcrotonic acid NIST Chemistry WebBook
methylmethacrylic acid ChEBI
tiglic acid ChEBI
Registry Numbers Types Sources
13201-46-2 CAS Registry Number ChemIDplus
13201-46-2 CAS Registry Number NIST Chemistry WebBook
217675 Gmelin Registry Number Gmelin
8541120 Reaxys Registry Number Reaxys
8541120 Beilstein Registry Number Beilstein
Citation Waiting for Citations Type Source
7558511 PubMed citation Europe PMC
Last Modified
08 July 2014