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2,2'-Dichlorobiphenyl

CAT: 0572-TRC-D433430-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D433430-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13029-08-8
Synonyms
1,1'-Biphenyl, 2,2'-dichloro-; Biphenyl, 2,2'-dichloro- (6CI,7CI,8CI); 2,2'-Dichloro-1,1'-biphenyl; 2,2'-DCBP; 2,2'-Dichlorobiphenyl; 2,2'-Dichlorodiphenyl; NSC 59902; PCB 4; o,o'-Dichlorobiphenyl; 2,2'-DiCB
Hazard Statement
May cause damage to organs through prolonged or repeated exposure; UN number: UN3432; Packing Group: II
Purity
>95% (HPLC)
Smiles
Clc1ccccc1c2ccccc2Cl
Molecular Formula
C12 H8 Cl2
Molecular Weight
223.1
InChI
InChI=1S/C12H8Cl2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H
Additionnal Information
IUPAC name: 1-chloro-2-(2-chlorophenyl)benzene
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

2,2'-Dichlorobiphenyl

Crystals. (NTP, 1992)

CAS Number13029-08-8
PubChem CID25622
IUPAC Name1-chloro-2-(2-chlorophenyl)benzene
Molecular FormulaC12H8Cl2
Molecular Weight223.09
XLogP5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity161
SMILES
C1=CC=C(C(=C1)C2=CC=CC=C2Cl)Cl
InChI
InChI=1S/C12H8Cl2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H
InChIKey
JAYCNKDKIKZTAF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2'-Dichlorobiphenyl
CAS: 13029-08-8
CID: 25622
Formula: C12H8Cl2
MW: 223.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight223.09
XLogP35
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass222.0003056
Monoisotopic Mass222.0003056
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity161
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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