4-hexyl-decanoic acid (CHEBI:179743)

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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	4-hexyl-decanoic acid

ChEBI ID	CHEBI:179743

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H32O2

Net Charge

Average Mass

256.430

Monoisotopic Mass

256.24023

InChI

InChI=1S/C16H32O2/c1-3-5-7-9-11-15(13-14-16(17)18)12-10-8-6-4-2/h15H,3-14H2,1-2H3,(H,17,18)

InChIKey

AZHXWUMGGSQNGZ-UHFFFAOYSA-N

SMILES

OC(=O)CCC(CCCCCC)CCCCCC

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	4-hexyl-decanoic acid (CHEBI:179743) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

4-hexyldecanoic acid