methyl (2,4,5-trichlorophenoxy)acetate

Synonyms: "2,4,5-T Methyl ester", "methyl (2,4,5-trichlorophenoxy)acetate", "2,4,5-trichlorophenoxyacetic acid methyl ester", "methyl 2-(2,4,5-trichlorophenoxy)acetate", "2,4,5-T-methyl ester", "methyl 2,4,5-trichlorophenoxyacetate", "methyl(2,4,5-trichlorophenoxy)acetate".

Source: methyl (2,4,5-trichlorophenoxy)acetate is used in pesticide compositions.

Identifiers:

IUPAC Name: methyl 2-(2,4,5-trichlorophenoxy)acetate
CAS Number: 1928-37-6
PubChem ID: 1482
InChiKey: JUCNGUOYQGHBJC-UHFFFAOYSA-N
Canonical SMILES: COC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl

Structural Properties:

Molecular Formula: C9H7Cl3O3
Molecular Weight: 269.502

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 3
Number of atoms different from hydrogen: 15

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Van den Berg KJ, van Raaij JAGM, Bragt PC, Notten WRF. 1991. Interactions of halogenated industrial chemicals with transthyretin and effects on thyroid hormone levels in vivo. Arch Toxicol 65(1):15-19. DOI: 10.1007/BF01973497. URL: https://link.springer.com/article/10.1007/BF01973497.

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