2-Hydroxyphenyl 4-methylbenzenesulfonate
TL;DR: 2-Hydroxyphenyl 4-methylbenzenesulfonate (CAS 35616-01-4) is a chemical compound with molecular formula C13H12O4S and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxyphenyl) 4-methylbenzenesulfonate
Also Known As: o-tosyloxyphenol, 2-(Tosyloxy)phenol, 2-hydroxyphenyl 4-methylbenzenesulfonate, pyrocatechol p-toluenesulfonate, (2-hydroxyphenyl) 4-methylbenzenesulfonate
| Molecular Formula | C13H12O4S |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | 2.46832 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.04562 |
| Heavy Atoms | 18 |
| Complexity | 644.9464 |
Chemical Identifiers
| CAS Number | 35616-01-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2O |
Product Overview
2-Hydroxyphenyl 4-methylbenzenesulfonate (CAS 35616-01-4), with molecular formula C13H12O4S and molecular weight 264.05 g/mol. IUPAC: (2-hydroxyphenyl) 4-methylbenzenesulfonate.
Chemical Property Profile of 2-Hydroxyphenyl 4-methylbenzenesulfonate
Property Insights of 2-Hydroxyphenyl 4-methylbenzenesulfonate
The XLogP value of 2.46832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyphenyl 4-methylbenzenesulfonate. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyphenyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 2-Hydroxyphenyl 4-methylbenzenesulfonate has 1 hydrogen bond donor(s) and 4 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 2-Hydroxyphenyl 4-methylbenzenesulfonate?
The CAS number of 2-Hydroxyphenyl 4-methylbenzenesulfonate is 35616-01-4.
What is the molecular formula of 2-Hydroxyphenyl 4-methylbenzenesulfonate?
The molecular formula of 2-Hydroxyphenyl 4-methylbenzenesulfonate is C13H12O4S.
What is the molecular weight of 2-Hydroxyphenyl 4-methylbenzenesulfonate?
The molecular weight of 2-Hydroxyphenyl 4-methylbenzenesulfonate is 264.05 g/mol.
Where can I buy 2-Hydroxyphenyl 4-methylbenzenesulfonate?
You can request a quote for 2-Hydroxyphenyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyphenyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyphenyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.