3-Phenoxypropionic acid (CHEBI:169989)

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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-Phenoxypropionic acid

ChEBI ID	CHEBI:169989

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H10O3

Net Charge

Average Mass

166.176

Monoisotopic Mass

166.06299

InChI

InChI=1S/C9H10O3/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)

InChIKey

BUSOTUQRURCMCM-UHFFFAOYSA-N

SMILES

O(CCC(O)=O)C1=CC=CC=C1

Metabolite of Species	Details
Mus Musculus (NCBI:txid10090)	Found in liver (BTO:0000759). of strain C57BL/6N Mouse [THESAURUS.OWL#C37385] See: MetaboLights Study
Mus Musculus (NCBI:txid10090)	Found in blood plasma (BTO:0000131). of strain C57BL/6N Mouse [THESAURUS.OWL#C37385] See: MetaboLights Study

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-Phenoxypropionic acid (CHEBI:169989) is a aromatic ether (CHEBI:35618) 3-Phenoxypropionic acid (CHEBI:169989) is a carboxylic acid (CHEBI:33575)

IUPAC Name

3-phenoxypropanoic acid

Registry Number	Type	Source
7170-38-9	CAS Registry Number	ChemIDplus