2,4,6-trichlorophenylhydrazine

Synonyms: "2,4,6-trichlorophenylhydrazine", "(2,4,6-trichlorophenyl)hydrazine", "2,4,6-trichlorophenyl hydrazine", "1-(2,4,6-Trichlorophenyl)hydrazine", "(2,4,6-trichlorphenyl)hydrazin", "2,4,6-trichlorphenylhydrazine", "2,4,6-trichloro phenylhydrazine".

Source: 2,4,6-Trichlorophenylhydrazine is used as a pharmaceutical intermediate.

Identifiers:

IUPAC Name: (2,4,6-trichlorophenyl)hydrazine
CAS Number: 04/12/5329
PubChem ID: 79234
InChiKey: MULHANRBCQBHII-UHFFFAOYSA-N
Canonical SMILES: C1=C(C=C(C(=C1Cl)NN)Cl)Cl

Structural Properties:

Molecular Formula: C₆H₅Cl₃N₂
Molecular Weight: 211.470

Pharmacophore Features:

Number of bond donors: 2
Number of bond acceptors: 2
Number of atoms different from hydrogen: 11

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

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Araki N, Ohno K, Nakai M, Takeyoshi M, Iida M. 2005. Screening for androgen receptor activities in 253 industrial chemicals by in vitro reporter gene assays using AR-EcoScreen cells. Toxicol In Vitro 19(6):831-842. DOI: 10.1016/j.tiv.2005.04.009. URL: http://www.sciencedirect.com/science/article/pii/S0887233305000706?via%3Dihub.