2,3,6-trichlorobiphenyl

Synonyms: "2,3,6-trichloro-1,1'-biphenyl", "PCB 24"

Source: 2,3,6-trichlorobiphenyl is a member of the polychlorinated biphenyl (PCB), a group of industrial chemicals used as dielectrics, coolants and lubricants in electrical equipment. PCBs contaminate water by leaching from landfills or other waste deposits.

Identifiers:

IUPAC Name: 1,2,4-trichloro-3-phenylbenzene
CAS Number: 55702-45-9
PubChem ID: 41540
InChiKey: LVROLHVSYNLFBE-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C(C=C1)C2=C(C=CC(=C2Cl)Cl)Cl

Structural Properties:

Molecular Formula: C₁₂H₇Cl₃
Molecular Weight: 257.543

Pharmacophore Features:

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

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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