CHEBI:231609 - (4-chloro-2-methylphenoxy)acetate

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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-chloro-2-methylphenoxy)acetate
ChEBI ID CHEBI:231609
Stars This entity has been manually annotated by a third party.
Submitter Elisabeth COUDERT
Supplier Information
Download Molfile XML SDF
Formula C9H8ClO3
Net Charge -1
Average Mass 199.610
Monoisotopic Mass 199.01675
InChI InChI=1S/C9H9ClO3/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)/p-1
InChIKey WHKUVVPPKQRRBV-UHFFFAOYSA-M
SMILES [O-]C(=O)COC1=C(C=C(C=C1)Cl)C
ChEBI Ontology
Outgoing (4-chloro-2-methylphenoxy)acetate (CHEBI:231609) is a chlorophenoxyacetate anion (CHEBI:23151)
(4-chloro-2-methylphenoxy)acetate (CHEBI:231609) is conjugate base of (4-chloro-2-methylphenoxy)acetic acid (CHEBI:50099)
Incoming (4-chloro-2-methylphenoxy)acetic acid (CHEBI:50099) is conjugate acid of (4-chloro-2-methylphenoxy)acetate (CHEBI:231609)
Synonym Source
(4-chloro-2-methylphenoxy)acetate UniProt
Manual Xref Database
CPD-10614 MetaCyc accession
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