Benzenesulfonate
TL;DR: Benzenesulfonate (CAS 3198-32-1) is a chemical compound with molecular formula C6H5O3S- and molecular weight 157.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfonate
Also Known As: Benzenesulfonate, besylate, benzensulfonate, Benzolsulfonat, benzenesulphonate
| Molecular Formula | C6H5O3S- |
|---|---|
| Molecular Weight | 157.00 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.99594 |
| Heavy Atoms | 10 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 3198-32-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)[O-] |
| InChIKey | SRSXLGNVWSONIS-UHFFFAOYSA-M |
Product Overview
Benzenesulfonate (CAS 3198-32-1), with molecular formula C6H5O3S- and molecular weight 157.00 g/mol. IUPAC: benzenesulfonate.
Chemical Property Profile of Benzenesulfonate
Property Insights of Benzenesulfonate
The XLogP value of -0.1 indicates that Benzenesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonate. Following Lipinski's Rule of Five, Benzenesulfonate has 0 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 Benzenesulfonate?
The CAS number of Benzenesulfonate is 3198-32-1.
What is the molecular formula of Benzenesulfonate?
The molecular formula of Benzenesulfonate is C6H5O3S-.
What is the molecular weight of Benzenesulfonate?
The molecular weight of Benzenesulfonate is 157.00 g/mol.
Where can I buy Benzenesulfonate?
You can request a quote for Benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.