2,4-dimethyl-dodecanoic acid (CHEBI:179790)

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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	2,4-dimethyl-dodecanoic acid

ChEBI ID	CHEBI:179790

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H28O2

Net Charge

Average Mass

228.376

Monoisotopic Mass

228.20893

InChI

InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-12(2)11-13(3)14(15)16/h12-13H,4-11H2,1-3H3,(H,15,16)

InChIKey

LLUSAGIILYQJOM-UHFFFAOYSA-N

SMILES

OC(=O)C(CC(CCCCCCCC)C)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	2,4-dimethyl-dodecanoic acid (CHEBI:179790) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

2,4-dimethyldodecanoic acid