2,2'-Dichlorobiphenyl

C12H8Cl2 — CID 25622

IUPAC1-chloro-2-(2-chlorophenyl)benzene
SMILESC1=CC=C(C(=C1)C2=CC=CC=C2Cl)Cl
InChIInChI=1S/C12H8Cl2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H
InChIKeyJAYCNKDKIKZTAF-UHFFFAOYSA-N
MW223.09 g/mol
LogP5.00
Rot. Bonds1

About 2,2'-Dichlorobiphenyl

2,2'-Dichlorobiphenyl (PubChem CID 25622) has the molecular formula C12H8Cl2 and a molecular weight of 223.09 g/mol. Its IUPAC name is 1-chloro-2-(2-chlorophenyl)benzene.

Molecular Properties

Compound Name2,2'-Dichlorobiphenyl
PubChem CID25622
Molecular FormulaC12H8Cl2
Molecular Weight223.09 g/mol
Exact Mass222.00
IUPAC Name1-chloro-2-(2-chlorophenyl)benzene
SMILESC1=CC=C(C(=C1)C2=CC=CC=C2Cl)Cl
InChIInChI=1S/C12H8Cl2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H
InChIKeyJAYCNKDKIKZTAF-UHFFFAOYSA-N
XLogP5.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity161

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.09
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2,2'-Dichlorobiphenyl with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

P,P'-ddd
CID 6294
1-Chloro-4-(2,2,2-trichloro-1-(4-chlorophenyl)ethyl)benzene
CID 3036
Mitotane
CID 4211
P,P'-dde
CID 3035
2,2',3,3',4-Pentachlorobiphenyl
CID 40470
1-Chloronaphthalene
CID 7003
3,3',5-Trichlorobiphenyl
CID 38037
O,P'-Ddt
CID 13089
3,3',5,5'-Tetrachlorobiphenyl
CID 36400
2,2',3,4'-Tetrachlorobiphenyl
CID 63103
Pcb 105
CID 36188
2-Chlorotoluene
CID 7238

Frequently Asked Questions

What is the IUPAC name of 2,2'-Dichlorobiphenyl?
The IUPAC name of 2,2'-Dichlorobiphenyl (CID 25622) is 1-chloro-2-(2-chlorophenyl)benzene.
What is the SMILES notation for 2,2'-Dichlorobiphenyl?
The canonical SMILES for 2,2'-Dichlorobiphenyl is C1=CC=C(C(=C1)C2=CC=CC=C2Cl)Cl.
What is the InChIKey of 2,2'-Dichlorobiphenyl?
The InChIKey is JAYCNKDKIKZTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H.
What are the key properties of 2,2'-Dichlorobiphenyl?
2,2'-Dichlorobiphenyl has a molecular weight of 223.09 g/mol, XLogP of 5.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2'-Dichlorobiphenyl is sourced from PubChem (CID 25622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).