4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol

C13H10Cl2O2 — CID 3037

💊View drug profile → dichlorophen
IUPAC4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol
SMILESOc1ccc(Cl)cc1Cc1cc(Cl)ccc1O
InChIInChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2
InChIKeyMDNWOSOZYLHTCG-UHFFFAOYSA-N
MW269.13 g/mol
LogP4.00
Rot. Bonds2

About 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol

4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol (PubChem CID 3037) has the molecular formula C13H10Cl2O2 and a molecular weight of 269.13 g/mol. Its IUPAC name is 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol.

Molecular Properties

Compound Name4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol
PubChem CID3037
Molecular FormulaC13H10Cl2O2
Molecular Weight269.13 g/mol
Exact Mass268.01
IUPAC Name4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol
SMILESOc1ccc(Cl)cc1Cc1cc(Cl)ccc1O
InChIInChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2
InChIKeyMDNWOSOZYLHTCG-UHFFFAOYSA-N
XLogP4.00
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-chloro-2-[(5-chloro-2-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

Related Compounds

Chlorophene
CID 8425
4-Chloro-2-methylphenol
CID 14855
2-Chloro-4-Phenylphenol
CID 7074
Bis(2-hydroxyphenyl)methane
CID 75575
Tetrachlorophene
CID 16023
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-4-biphenylol
CID 91589
2-Phenyl-6-chlorophenol
CID 61529

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol?
The IUPAC name of 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol (CID 3037) is 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol.
What is the SMILES notation for 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol?
The canonical SMILES for 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol is Oc1ccc(Cl)cc1Cc1cc(Cl)ccc1O.
What is the InChIKey of 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol?
The InChIKey is MDNWOSOZYLHTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2.
What are the key properties of 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol?
4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol has a molecular weight of 269.13 g/mol, XLogP of 4.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol is sourced from PubChem (CID 3037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).