2,3,5,6-Tetramethylbenzenesulfonyl chloride
TL;DR: 2,3,5,6-Tetramethylbenzenesulfonyl chloride (CAS 60706-63-0) is a chemical compound with molecular formula C10H13ClO2S and molecular weight 232.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetramethylbenzenesulfonyl chloride
Also Known As: 2,3,5,6-Tetramethylbenzenesulfonyl chloride, 2,3,5,6-tetramethylbenzene-1-sulfonyl chloride, durylsulphonyl chloride, 2,3,5,6-Tetramethylbenzenesulphonyl chloride, 2,3,5,6-TetraMethyl-Benzenesulfonyl Chloride
| Molecular Formula | C10H13ClO2S |
|---|---|
| Molecular Weight | 232.03 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.03249 |
| Heavy Atoms | 14 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 60706-63-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C)S(=O)(=O)Cl)C)C |
| InChIKey | ZCXRROBIIMQMHR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,5,6-Tetramethylbenzenesulfonyl chloride (CAS 60706-63-0), with molecular formula C10H13ClO2S and molecular weight 232.03 g/mol. IUPAC: 2,3,5,6-tetramethylbenzenesulfonyl chloride.
Chemical Property Profile of 2,3,5,6-Tetramethylbenzenesulfonyl chloride
Property Insights of 2,3,5,6-Tetramethylbenzenesulfonyl chloride
The XLogP value of 3.4 indicates that 2,3,5,6-Tetramethylbenzenesulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 2,3,5,6-Tetramethylbenzenesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6-Tetramethylbenzenesulfonyl chloride has 0 hydrogen bond donor(s) and 2 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 2,3,5,6-Tetramethylbenzenesulfonyl chloride?
The CAS number of 2,3,5,6-Tetramethylbenzenesulfonyl chloride is 60706-63-0.
What is the molecular formula of 2,3,5,6-Tetramethylbenzenesulfonyl chloride?
The molecular formula of 2,3,5,6-Tetramethylbenzenesulfonyl chloride is C10H13ClO2S.
What is the molecular weight of 2,3,5,6-Tetramethylbenzenesulfonyl chloride?
The molecular weight of 2,3,5,6-Tetramethylbenzenesulfonyl chloride is 232.03 g/mol.
Where can I buy 2,3,5,6-Tetramethylbenzenesulfonyl chloride?
You can request a quote for 2,3,5,6-Tetramethylbenzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6-Tetramethylbenzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6-Tetramethylbenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.