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2,4,4'-trichlorobiphenyl

2,4,4'-trichlorobiphenyl

CAS: 7012-37-5

Formula: C12H7Cl3

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

IUPAC: 2,4,4'-trichloro-1,1'-biphenyl

InChI: InChI=1S/C12H7Cl3/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7H

Composition: C (55.97%), H (2.74%), Cl (41.29%)

Molar Mass: 257.54

Atom Count: 22

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 255.9613333
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey BZTYNSQSZHARAZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 65.61
Topological Polar Surface Area 0
Polarizability 26.87
Ring Count 2
Rotatable Bond Count 1

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