polychlorobiphenyl

polychlorobiphenyl

CAS: 2050-68-2

Formula: C12H8Cl2

SMILES: ClC1=CC=C(C=C1)C1=CC=C(Cl)C=C1

IUPAC: 4,4'-dichloro-1,1'-biphenyl

InChI: InChI=1S/C12H8Cl2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H

Composition: C (64.61%), H (3.61%), Cl (31.78%)

Molar Mass: 223.1

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	4-dcb cpd; p,p-DCBP; p,p-dcbp; polychlorobiphenyl
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	222.0003057
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	YTBRNEUEFCNVHC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.8
Topological Polar Surface Area	0
Polarizability	25.01
Ring Count	2
Rotatable Bond Count	1

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