4-((4-Methylphenyl)sulfonyl)phenol
TL;DR: 4-((4-Methylphenyl)sulfonyl)phenol (CAS 7402-77-9) is a chemical compound with molecular formula C13H12O3S and molecular weight 248.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)sulfonylphenol
Also Known As: 4-Tosylphenol, 4-((4-Methylphenyl)sulfonyl)phenol, 4-(4-methylphenyl)sulfonylphenol, 4-(p-tolylsulfonyl)phenol, 4-Methyl-4'-hydroxydiphenyl sulfone
| Molecular Formula | C13H12O3S |
|---|---|
| Molecular Weight | 248.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.05072 |
| Heavy Atoms | 17 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 7402-77-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)O |
| InChIKey | PTARVWLPQZIRCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((4-Methylphenyl)sulfonyl)phenol (CAS 7402-77-9), with molecular formula C13H12O3S and molecular weight 248.05 g/mol. IUPAC: 4-(4-methylphenyl)sulfonylphenol.
Chemical Property Profile of 4-((4-Methylphenyl)sulfonyl)phenol
Property Insights of 4-((4-Methylphenyl)sulfonyl)phenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((4-Methylphenyl)sulfonyl)phenol. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((4-Methylphenyl)sulfonyl)phenol. Following Lipinski's Rule of Five, 4-((4-Methylphenyl)sulfonyl)phenol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((4-Methylphenyl)sulfonyl)phenol?
The CAS number of 4-((4-Methylphenyl)sulfonyl)phenol is 7402-77-9.
What is the molecular formula of 4-((4-Methylphenyl)sulfonyl)phenol?
The molecular formula of 4-((4-Methylphenyl)sulfonyl)phenol is C13H12O3S.
What is the molecular weight of 4-((4-Methylphenyl)sulfonyl)phenol?
The molecular weight of 4-((4-Methylphenyl)sulfonyl)phenol is 248.05 g/mol.
Where can I buy 4-((4-Methylphenyl)sulfonyl)phenol?
You can request a quote for 4-((4-Methylphenyl)sulfonyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Methylphenyl)sulfonyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Methylphenyl)sulfonyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.