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2,3,3',4,4',5'-hexachloro-1,1'-biphenyl

2,3,3',4,4',5'-hexachloro-1,1'-biphenyl

CAS: 69782-90-7

Formula: C12H4Cl6

SMILES: ClC1=CC(=CC(Cl)=C1Cl)C1=C(Cl)C(Cl)=C(Cl)C=C1

IUPAC: 2,3,3',4,4',5'-hexachloro-1,1'-biphenyl

InChI: InChI=1S/C12H4Cl6/c13-7-2-1-6(10(16)12(7)18)5-3-8(14)11(17)9(15)4-5/h1-4H

Composition: C (39.94%), H (1.12%), Cl (58.94%)

Molar Mass: 360.86

Atom Count: 22

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 357.8444163
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey YTWXDQVNPCIEOX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 80.02
Topological Polar Surface Area 0
Polarizability 32.71
Ring Count 2
Rotatable Bond Count 1

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