3-(Methylsulfonyl)benzenesulfonyl chloride
TL;DR: 3-(Methylsulfonyl)benzenesulfonyl chloride (CAS 162101-25-9) is a chemical compound with molecular formula C7H7ClO4S2 and molecular weight 253.94743 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methylsulfonylbenzenesulfonyl chloride
Also Known As: 3-(METHYLSULFONYL)BENZENESULFONYL CHLORIDE, 3-methylsulfonylbenzenesulfonyl chloride, 2,6-Difluorophenylboronic acid, 3-Mesylbenzenesulfonyl chloride, 3-(methylsulphonyl)benzenesulphonyl chloride
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H7ClO4S2 |
| Molecular Weight | 253.94743 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.94743 Da |
| Heavy Atoms | 14 |
| Complexity | 386.0 |
| SMILES | CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)Cl |
| InChIKey | CQEFJGDLGWJIRV-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Methylsulfonyl)benzenesulfonyl chloride
Property Insights of 3-(Methylsulfonyl)benzenesulfonyl chloride
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Methylsulfonyl)benzenesulfonyl chloride. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Methylsulfonyl)benzenesulfonyl chloride. Following Lipinski's Rule of Five, 3-(Methylsulfonyl)benzenesulfonyl chloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Methylsulfonyl)benzenesulfonyl chloride?
The CAS number of 3-(Methylsulfonyl)benzenesulfonyl chloride is 162101-25-9.
What is the molecular formula of 3-(Methylsulfonyl)benzenesulfonyl chloride?
The molecular formula of 3-(Methylsulfonyl)benzenesulfonyl chloride is C7H7ClO4S2.
What is the molecular weight of 3-(Methylsulfonyl)benzenesulfonyl chloride?
The molecular weight of 3-(Methylsulfonyl)benzenesulfonyl chloride is 253.94743 g/mol.
Where can I buy 3-(Methylsulfonyl)benzenesulfonyl chloride?
You can request a quote for 3-(Methylsulfonyl)benzenesulfonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Methylsulfonyl)benzenesulfonyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-(Methylsulfonyl)benzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.