3-Methyleneheptanoic acid (CHEBI:180306)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3-Methyleneheptanoic acid

ChEBI ID	CHEBI:180306

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H14O2

Net Charge

Average Mass

142.198

Monoisotopic Mass

142.09938

InChI

InChI=1S/C8H14O2/c1-3-4-5-7(2)6-8(9)10/h2-6H2,1H3,(H,9,10)

InChIKey

DURJBIVOBGHCHY-UHFFFAOYSA-N

SMILES

OC(=O)CC(CCCC)=C

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	3-Methyleneheptanoic acid (CHEBI:180306) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

3-methylideneheptanoic acid