MCPA
Synonyms: "2-methyl-4-chlorophenoxyacetic acid", "agroxone", "metaxon", "zelan", "(4-chloro-2-methylphenoxy)acetic acid", "bordermaster", "agroxon", "chiptox"
Source: MCPA is a systemic phenoxy herbicide.
Identifiers:
IUPAC Name: 2-(4-chloro-2-methylphenoxy)acetic acid
CAS Number: 94-74-6
PubChem ID: 7204
InChiKey: WHKUVVPPKQRRBV-UHFFFAOYSA-N
Canonical SMILES: CC1=C(C=CC(=C1)Cl)OCC(=O)O
Structural Properties:
Molecular Formula: C9H9ClO3
Molecular Weight: 200.619
Pharmacophore Features:
Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 13
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3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors
Orton F, Lutz I, Kloas W, Routledge EJ. 2009. Endocrine disrupting effects of herbicides and pentachlorophenol: in vitro and in vivo evidence. Environ Sci Technol 43(6):2144-2150.