3,4-dichloroaniline

Synonyms: "3,4-dichlorobenzenamine", "4,5-dichloroaniline", "3,4-dichloranilin", "1-amino-3,4-dichlorobenzene"

Source: 3,4-dichloroaniline is used as an intermediate in the production of dyes and herbicides.

Identifiers:

IUPAC Name: 3,4-dichloroaniline
CAS Number: 95-76-1
PubChem ID: 7257
InChiKey: SDYWXFYBZPNOFX-UHFFFAOYSA-N
Canonical SMILES: C1=CC(=C(C=C1N)Cl)Cl

Structural Properties:

Molecular Formula: C₆H₅Cl₂N
Molecular Weight: 162.017

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 9

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3D structure (.sdf)
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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Cook JC, Mullin LS, Frame SR, Biegel LB. 1993. Investigation of a mechanism for Leydig cell tumorigenesis by linuron in rats. Toxicol Appl Pharmacol 119(2):195-204.