Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-
TL;DR: Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- (CAS 59687-73-9) is a chemical compound with molecular formula C14H12O6S and molecular weight 308.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-(4-methylphenyl)sulfonyloxybenzoic acid
Also Known As: Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-, 2-Hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)benzoic acid, 2-hydroxy-5-(4-methylphenyl)sulfonyloxybenzoic acid, 2-Hydroxy-5-[(4-methylbenzene-1-sulfonyl)oxy]benzoic acid, RefChem:326896
| Molecular Formula | C14H12O6S |
|---|---|
| Molecular Weight | 308.04 g/mol |
| LogP | 2.16652 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.03546 |
| Heavy Atoms | 21 |
| Complexity | 777.6116 |
Chemical Identifiers
| CAS Number | 59687-73-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)O)C(=O)O |
Product Overview
Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- (CAS 59687-73-9), with molecular formula C14H12O6S and molecular weight 308.04 g/mol. IUPAC: 2-hydroxy-5-(4-methylphenyl)sulfonyloxybenzoic acid.
Chemical Property Profile of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-
Property Insights of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-
The XLogP value of 2.16652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-. Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- has 2 hydrogen bond donor(s) and 5 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 Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-?
The CAS number of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- is 59687-73-9.
What is the molecular formula of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-?
The molecular formula of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- is C14H12O6S.
What is the molecular weight of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-?
The molecular weight of Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- is 308.04 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-?
You can request a quote for Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-5-(((4-methylphenyl)sulfonyl)oxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.