4-(3,4-dichlorophenyl)phenol

C12H8Cl2O — CID 6452909

IUPAC4-(3,4-dichlorophenyl)phenol
SMILESOc1ccc(-c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C12H8Cl2O/c13-11-6-3-9(7-12(11)14)8-1-4-10(15)5-2-8/h1-7,15H
InChIKeyUTTIPSVNOWSCRD-UHFFFAOYSA-N
MW239.10 g/mol
LogP4.37
Rot. Bonds1

About 4-(3,4-dichlorophenyl)phenol

4-(3,4-dichlorophenyl)phenol (PubChem CID 6452909) has the molecular formula C12H8Cl2O and a molecular weight of 239.10 g/mol. Its IUPAC name is 4-(3,4-dichlorophenyl)phenol.

Molecular Properties

Compound Name4-(3,4-dichlorophenyl)phenol
PubChem CID6452909
Molecular FormulaC12H8Cl2O
Molecular Weight239.10 g/mol
Exact Mass238.00
IUPAC Name4-(3,4-dichlorophenyl)phenol
SMILESOc1ccc(-c2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C12H8Cl2O/c13-11-6-3-9(7-12(11)14)8-1-4-10(15)5-2-8/h1-7,15H
InChIKeyUTTIPSVNOWSCRD-UHFFFAOYSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.10
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(3,4-dichlorophenyl)phenol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dichlorophenyl)phenol?
The IUPAC name of 4-(3,4-dichlorophenyl)phenol (CID 6452909) is 4-(3,4-dichlorophenyl)phenol.
What is the SMILES notation for 4-(3,4-dichlorophenyl)phenol?
The canonical SMILES for 4-(3,4-dichlorophenyl)phenol is Oc1ccc(-c2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of 4-(3,4-dichlorophenyl)phenol?
The InChIKey is UTTIPSVNOWSCRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2O/c13-11-6-3-9(7-12(11)14)8-1-4-10(15)5-2-8/h1-7,15H.
What are the key properties of 4-(3,4-dichlorophenyl)phenol?
4-(3,4-dichlorophenyl)phenol has a molecular weight of 239.10 g/mol, XLogP of 4.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dichlorophenyl)phenol is sourced from PubChem (CID 6452909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).