CHEBI:110166 - 2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester

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ChEBI Name 2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester
ChEBI ID CHEBI:110166
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H22Cl2O3
Net Charge 0
Average Mass 333.251
Monoisotopic Mass 332.09460
InChI InChI=1S/C16H22Cl2O3/c1-3-4-5-6-7-12(2)21-16(19)11-20-15-9-8-13(17)10-14(15)18/h8-10,12H,3-7,11H2,1-2H3
InChIKey GJNVTNDAZUATRV-UHFFFAOYSA-N
SMILES CCCCCCC(C)OC(=O)COC1=C(C=C(C=C1)Cl)Cl
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-(2,4-dichlorophenoxy)acetic acid octan-2-yl ester (CHEBI:110166) is a monocarboxylic acid (CHEBI:25384)
Manual Xref Database
LSM-21595 LINCS
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