diclofop-methyl

Synonyms: "dichlorfop-methyl", "diclofop methyl", "illoxan", "methyldiclofop", "hoegrass", "hoelon", "methyl diclofop", "dichlordiphenprop"

Source: the active ingredient diclofop-methyl is found in a variety of commercial herbicides.

Identifiers:

IUPAC Name: methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
CAS Number: 51338-27-3
PubChem ID: 39985
InChiKey: BACHBFVBHLGWSL-UHFFFAOYSA-N
Canonical SMILES: CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl

Structural Properties:

Molecular Formula: C16H14Cl2O4
Molecular Weight: 341.186

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 2
Number of atoms different from hydrogen: 22

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3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors
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Petit F, Le Goff P, Cravedi JP, Valotaire Y, Pakdel F. 1997. Two complementary bioassays for screening the estrogenic potency of xenobiotics: recombinant yeast for trout estrogen receptor and trout hepatocyte cultures. J Mol Endocrinol 19(3):321-335.

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