4-chloro-2-(2,5-dimethylphenyl)phenol

C14H13ClO — CID 83130826

IUPAC4-chloro-2-(2,5-dimethylphenyl)phenol
SMILESCc1ccc(C)c(-c2cc(Cl)ccc2O)c1
InChIInChI=1S/C14H13ClO/c1-9-3-4-10(2)12(7-9)13-8-11(15)5-6-14(13)16/h3-8,16H,1-2H3
InChIKeyLBCAIYXVGGXLIY-UHFFFAOYSA-N
MW232.71 g/mol
LogP4.33
Rot. Bonds1

About 4-chloro-2-(2,5-dimethylphenyl)phenol

4-chloro-2-(2,5-dimethylphenyl)phenol (PubChem CID 83130826) has the molecular formula C14H13ClO and a molecular weight of 232.71 g/mol. Its IUPAC name is 4-chloro-2-(2,5-dimethylphenyl)phenol.

Molecular Properties

Compound Name4-chloro-2-(2,5-dimethylphenyl)phenol
PubChem CID83130826
Molecular FormulaC14H13ClO
Molecular Weight232.71 g/mol
Exact Mass232.07
IUPAC Name4-chloro-2-(2,5-dimethylphenyl)phenol
SMILESCc1ccc(C)c(-c2cc(Cl)ccc2O)c1
InChIInChI=1S/C14H13ClO/c1-9-3-4-10(2)12(7-9)13-8-11(15)5-6-14(13)16/h3-8,16H,1-2H3
InChIKeyLBCAIYXVGGXLIY-UHFFFAOYSA-N
XLogP4.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-chloro-2-(2,5-dimethylphenyl)phenol 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

Dichlorophen
CID 3037
Chlorophene
CID 8425
4-Chloro-2-methylphenol
CID 14855
Chlorothymol
CID 6982
4-Chloro-2-methyl-5-(1-methylethyl)phenol
CID 21874
Dowicide 9
CID 61594
2-Hydroxy-3,5-dichlorobiphenyl
CID 21419
Trichlorophene
CID 62616
4-Chloro-2-phenylphenol
CID 11827
2,2'-Methylenebis(4-chloro-6-methylphenol)
CID 253827
4-Chloro-1-naphthol
CID 11787
2-Phenyl-6-chlorophenol
CID 61529

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(2,5-dimethylphenyl)phenol?
The IUPAC name of 4-chloro-2-(2,5-dimethylphenyl)phenol (CID 83130826) is 4-chloro-2-(2,5-dimethylphenyl)phenol.
What is the SMILES notation for 4-chloro-2-(2,5-dimethylphenyl)phenol?
The canonical SMILES for 4-chloro-2-(2,5-dimethylphenyl)phenol is Cc1ccc(C)c(-c2cc(Cl)ccc2O)c1.
What is the InChIKey of 4-chloro-2-(2,5-dimethylphenyl)phenol?
The InChIKey is LBCAIYXVGGXLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClO/c1-9-3-4-10(2)12(7-9)13-8-11(15)5-6-14(13)16/h3-8,16H,1-2H3.
What are the key properties of 4-chloro-2-(2,5-dimethylphenyl)phenol?
4-chloro-2-(2,5-dimethylphenyl)phenol has a molecular weight of 232.71 g/mol, XLogP of 4.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2,5-dimethylphenyl)phenol is sourced from PubChem (CID 83130826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).