2-(4-bromo-2-chlorophenyl)-4-chlorophenol

C12H7BrCl2O — CID 142753932

IUPAC2-(4-bromo-2-chlorophenyl)-4-chlorophenol
SMILESOc1ccc(Cl)cc1-c1ccc(Br)cc1Cl
InChIInChI=1S/C12H7BrCl2O/c13-7-1-3-9(11(15)5-7)10-6-8(14)2-4-12(10)16/h1-6,16H
InChIKeyWWNVAUJUXPPIHN-UHFFFAOYSA-N
MW318.00 g/mol
LogP5.13
Rot. Bonds1

About 2-(4-bromo-2-chlorophenyl)-4-chlorophenol

2-(4-bromo-2-chlorophenyl)-4-chlorophenol (PubChem CID 142753932) has the molecular formula C12H7BrCl2O and a molecular weight of 318.00 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenyl)-4-chlorophenol.

Molecular Properties

Compound Name2-(4-bromo-2-chlorophenyl)-4-chlorophenol
PubChem CID142753932
Molecular FormulaC12H7BrCl2O
Molecular Weight318.00 g/mol
Exact Mass315.91
IUPAC Name2-(4-bromo-2-chlorophenyl)-4-chlorophenol
SMILESOc1ccc(Cl)cc1-c1ccc(Br)cc1Cl
InChIInChI=1S/C12H7BrCl2O/c13-7-1-3-9(11(15)5-7)10-6-8(14)2-4-12(10)16/h1-6,16H
InChIKeyWWNVAUJUXPPIHN-UHFFFAOYSA-N
XLogP5.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.00
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-bromo-2-chlorophenyl)-4-chlorophenol 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

2-(2,4-dichlorophenyl)-4-methylphenol
CID 83130752
5-chloro-2-(2,4-dichlorophenyl)phenol
CID 174783468
4-chloro-2-(4-chloro-2-fluorophenyl)phenol
CID 83130792
1-(5-bromo-2-fluorophenyl)-2-chloro-4-(2,5-dichlorophenyl)-5-fluorobenzene
CID 123513311
4-(5-bromo-2-fluorophenyl)-3-chloroaniline
CID 107615868
4-bromo-2-(2-hydroxyphenyl)phenol
CID 11219298
4-(5-bromo-2-fluorophenyl)-3-chlorobenzoic acid
CID 81308229
5-(5-bromo-2-fluorophenyl)-2-chlorophenol
CID 83130970
(4-bromo-2-chlorophenyl)-(2,5-dichlorophenyl)methanone
CID 43805120
2-(5-bromo-2-fluorophenyl)phenol
CID 83128574
4-bromo-2-chloro-1-phenylbenzene
CID 13457416
4-bromo-2-(5-bromo-2-methylphenyl)phenol
CID 170237414

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chlorophenyl)-4-chlorophenol?
The IUPAC name of 2-(4-bromo-2-chlorophenyl)-4-chlorophenol (CID 142753932) is 2-(4-bromo-2-chlorophenyl)-4-chlorophenol.
What is the SMILES notation for 2-(4-bromo-2-chlorophenyl)-4-chlorophenol?
The canonical SMILES for 2-(4-bromo-2-chlorophenyl)-4-chlorophenol is Oc1ccc(Cl)cc1-c1ccc(Br)cc1Cl.
What is the InChIKey of 2-(4-bromo-2-chlorophenyl)-4-chlorophenol?
The InChIKey is WWNVAUJUXPPIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrCl2O/c13-7-1-3-9(11(15)5-7)10-6-8(14)2-4-12(10)16/h1-6,16H.
What are the key properties of 2-(4-bromo-2-chlorophenyl)-4-chlorophenol?
2-(4-bromo-2-chlorophenyl)-4-chlorophenol has a molecular weight of 318.00 g/mol, XLogP of 5.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenyl)-4-chlorophenol is sourced from PubChem (CID 142753932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).