CHEBI:168029 - Ethyl 4-methylphenoxyacetate

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ChEBI Name Ethyl 4-methylphenoxyacetate
ChEBI ID CHEBI:168029
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H14O3
Net Charge 0
Average Mass 194.230
Monoisotopic Mass 194.09429
InChI InChI=1S/C11H14O3/c1-3-13-11(12)8-14-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3
InChIKey UMNOIMVMNARUSB-UHFFFAOYSA-N
SMILES O(C1=CC=C(C=C1)C)CC(OCC)=O
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue 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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ethyl 4-methylphenoxyacetate (CHEBI:168029) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name
ethyl 2-(4-methylphenoxy)acetate
Manual Xrefs Databases
3263307 ChemSpider
HMDB0034206 HMDB
View more database links
Registry Number Type Source
67028-40-4 CAS Registry Number ChemIDplus