Benzenesulfonic acid, dimethyl-
TL;DR: Benzenesulfonic acid, dimethyl- (CAS 25321-41-9) is a chemical compound with molecular formula C8H10O3S and molecular weight 186.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethylbenzenesulfonic acid
Also Known As: 2,3-dimethylbenzenesulfonic acid, Xylenesulfonic acid, Xylenesulphonic acid, 2,3-Xylenesulfonic acid, Xylene sulfonic acid
| Molecular Formula | C8H10O3S |
|---|---|
| Molecular Weight | 186.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.03506 |
| Heavy Atoms | 12 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 25321-41-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)S(=O)(=O)O)C |
| InChIKey | ZZXDRXVIRVJQBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenesulfonic acid, dimethyl- (CAS 25321-41-9), with molecular formula C8H10O3S and molecular weight 186.04 g/mol. IUPAC: 2,3-dimethylbenzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, dimethyl-
Property Insights of Benzenesulfonic acid, dimethyl-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonic acid, dimethyl-. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, dimethyl-. Following Lipinski's Rule of Five, Benzenesulfonic acid, dimethyl- 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 Benzenesulfonic acid, dimethyl-?
The CAS number of Benzenesulfonic acid, dimethyl- is 25321-41-9.
What is the molecular formula of Benzenesulfonic acid, dimethyl-?
The molecular formula of Benzenesulfonic acid, dimethyl- is C8H10O3S.
What is the molecular weight of Benzenesulfonic acid, dimethyl-?
The molecular weight of Benzenesulfonic acid, dimethyl- is 186.04 g/mol.
Where can I buy Benzenesulfonic acid, dimethyl-?
You can request a quote for Benzenesulfonic acid, dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.