4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol

C19H15ClO2 — CID 511799

IUPAC4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol
SMILESOc1ccc(C(c2ccc(O)cc2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H15ClO2/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,19,21-22H
InChIKeyIJSGQDFHZUWQES-UHFFFAOYSA-N
MW310.78 g/mol
LogP4.93
Rot. Bonds3

About 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol

4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol (PubChem CID 511799) has the molecular formula C19H15ClO2 and a molecular weight of 310.78 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol.

Molecular Properties

Compound Name4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol
PubChem CID511799
Molecular FormulaC19H15ClO2
Molecular Weight310.78 g/mol
Exact Mass310.08
IUPAC Name4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol
SMILESOc1ccc(C(c2ccc(O)cc2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H15ClO2/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,19,21-22H
InChIKeyIJSGQDFHZUWQES-UHFFFAOYSA-N
XLogP4.93
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]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-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol?
The IUPAC name of 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol (CID 511799) is 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol.
What is the SMILES notation for 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol?
The canonical SMILES for 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol is Oc1ccc(C(c2ccc(O)cc2)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol?
The InChIKey is IJSGQDFHZUWQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClO2/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,19,21-22H.
What are the key properties of 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol?
4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol has a molecular weight of 310.78 g/mol, XLogP of 4.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-chlorophenyl)-(4-hydroxyphenyl)methyl]phenol is sourced from PubChem (CID 511799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).