CHEBI:19331 - (2,4,5-trichlorophenoxy)acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2,4,5-trichlorophenoxy)acetate
ChEBI ID CHEBI:19331
Definition A chlorophenoxyacetate anion obtained by deprotonation of the carboxy group of (2,4,5-trichlorophenoxy)acetic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C8H4Cl3O3
Net Charge -1
Average Mass 254.47366
Monoisotopic Mass 252.92315
InChI InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13)/p-1
InChIKey SMYMJHWAQXWPDB-UHFFFAOYSA-M
SMILES [O-]C(=O)COc1cc(Cl)c(Cl)cc1Cl
ChEBI Ontology
Outgoing (2,4,5-trichlorophenoxy)acetate (CHEBI:19331) is a chlorophenoxyacetate anion (CHEBI:23151)
(2,4,5-trichlorophenoxy)acetate (CHEBI:19331) is conjugate base of (2,4,5-trichlorophenoxy)acetic acid (CHEBI:27903)
Incoming (2,4,5-trichlorophenoxy)acetic acid (CHEBI:27903) is conjugate acid of (2,4,5-trichlorophenoxy)acetate (CHEBI:19331)
IUPAC Name
(2,4,5-trichlorophenoxy)acetate
Synonym Source
2,4,5-trichlorophenoxyacetate ChEBI
Manual Xrefs Databases
c0361 UM-BBD
CPD-10896 MetaCyc
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Registry Number Type Source
434053 Gmelin Registry Number Gmelin
Last Modified
21 July 2014