2-Bromobenzenesulfonyl chloride
TL;DR: 2-Bromobenzenesulfonyl chloride (CAS 705-21-5) is a chemical compound with molecular formula C6H4BrClO2S and molecular weight 253.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromobenzenesulfonyl chloride
Also Known As: 2-Bromobenzenesulfonyl chloride, 2-Bromobenzenesulphonyl chloride, 2-Bromobenzene-1-Sulfonyl Chloride, null, 2-bromosulfonyl chloride
| Molecular Formula | C6H4BrClO2S |
|---|---|
| Molecular Weight | 253.88 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.88039 |
| Heavy Atoms | 11 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 705-21-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)S(=O)(=O)Cl)Br |
| InChIKey | VFPWGZNNRSQPBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromobenzenesulfonyl chloride (CAS 705-21-5), with molecular formula C6H4BrClO2S and molecular weight 253.88 g/mol. IUPAC: 2-bromobenzenesulfonyl chloride.
Chemical Property Profile of 2-Bromobenzenesulfonyl chloride
Property Insights of 2-Bromobenzenesulfonyl chloride
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromobenzenesulfonyl chloride. With a topological polar surface area (TPSA) of 42.5 Ų, 2-Bromobenzenesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromobenzenesulfonyl 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-Bromobenzenesulfonyl chloride?
The CAS number of 2-Bromobenzenesulfonyl chloride is 705-21-5.
What is the molecular formula of 2-Bromobenzenesulfonyl chloride?
The molecular formula of 2-Bromobenzenesulfonyl chloride is C6H4BrClO2S.
What is the molecular weight of 2-Bromobenzenesulfonyl chloride?
The molecular weight of 2-Bromobenzenesulfonyl chloride is 253.88 g/mol.
Where can I buy 2-Bromobenzenesulfonyl chloride?
You can request a quote for 2-Bromobenzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromobenzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromobenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.