2-(2-hydroxyphenyl)sulfonyl-3-methylphenol

C13H12O4S — CID 101301572

IUPAC2-(2-hydroxyphenyl)sulfonyl-3-methylphenol
SMILESCc1cccc(O)c1S(=O)(=O)c1ccccc1O
InChIInChI=1S/C13H12O4S/c1-9-5-4-7-11(15)13(9)18(16,17)12-8-3-2-6-10(12)14/h2-8,14-15H,1H3
InChIKeyRARVOZPTUBQVMO-UHFFFAOYSA-N
MW264.30 g/mol
LogP2.24
Rot. Bonds2

About 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol

2-(2-hydroxyphenyl)sulfonyl-3-methylphenol (PubChem CID 101301572) has the molecular formula C13H12O4S and a molecular weight of 264.30 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)sulfonyl-3-methylphenol
PubChem CID101301572
Molecular FormulaC13H12O4S
Molecular Weight264.30 g/mol
Exact Mass264.05
IUPAC Name2-(2-hydroxyphenyl)sulfonyl-3-methylphenol
SMILESCc1cccc(O)c1S(=O)(=O)c1ccccc1O
InChIInChI=1S/C13H12O4S/c1-9-5-4-7-11(15)13(9)18(16,17)12-8-3-2-6-10(12)14/h2-8,14-15H,1H3
InChIKeyRARVOZPTUBQVMO-UHFFFAOYSA-N
XLogP2.24
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol 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-(4-hydroxy-2-methylphenyl)sulfonyl-3-methylphenol
CID 101301757
4-methyl-3-(2-methylphenyl)sulfonylbenzene-1,2-diol
CID 101301646
4-(2-hydroxy-6-methylphenyl)sulfonyl-2,6-dimethylphenol
CID 101301909
formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol
CID 6452549
2-(4-methylphenyl)sulfonylphenol
CID 10879464
3-(2-hydroxyphenyl)sulfonyl-2,6-dimethylphenol
CID 101301613
4-(2-hydroxyphenyl)sulfonyl-2-methylphenol
CID 101301578
benzene-1,2,3-triol;tris(2-methylbenzenesulfonic acid)
CID 175309354
3-(2-hydroxy-3-methylphenyl)sulfonyl-2,6-dimethylphenol
CID 101301834
2-methylbenzenesulfonamide
CID 6924
2-methylbenzenesulfonic acid
CID 6925
2-methylbenzenesulfonic acid;hydroiodide
CID 173271723

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol?
The IUPAC name of 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol (CID 101301572) is 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol.
What is the SMILES notation for 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol?
The canonical SMILES for 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol is Cc1cccc(O)c1S(=O)(=O)c1ccccc1O.
What is the InChIKey of 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol?
The InChIKey is RARVOZPTUBQVMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O4S/c1-9-5-4-7-11(15)13(9)18(16,17)12-8-3-2-6-10(12)14/h2-8,14-15H,1H3.
What are the key properties of 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol?
2-(2-hydroxyphenyl)sulfonyl-3-methylphenol has a molecular weight of 264.30 g/mol, XLogP of 2.24, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)sulfonyl-3-methylphenol is sourced from PubChem (CID 101301572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).