(4-Bromophenyl)methanesulfonyl chloride
TL;DR: (4-Bromophenyl)methanesulfonyl chloride (CAS 53531-69-4) is a chemical compound with molecular formula C7H6BrClO2S and molecular weight 267.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methanesulfonyl chloride
Also Known As: 4-Bromobenzylsulfonyl chloride, (4-Bromophenyl)methanesulfonyl chloride, benzenemethanesulfonyl chloride, 4-bromo-, 4-bromobenzylsulphonyl chloride, 4-bromobenzylsulfonylchloride
| Molecular Formula | C7H6BrClO2S |
|---|---|
| Molecular Weight | 267.90 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.89603 |
| Heavy Atoms | 12 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 53531-69-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CS(=O)(=O)Cl)Br |
| InChIKey | ZWVWFWGJZPHCHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Bromophenyl)methanesulfonyl chloride (CAS 53531-69-4), with molecular formula C7H6BrClO2S and molecular weight 267.90 g/mol. IUPAC: (4-bromophenyl)methanesulfonyl chloride.
Chemical Property Profile of (4-Bromophenyl)methanesulfonyl chloride
Property Insights of (4-Bromophenyl)methanesulfonyl chloride
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Bromophenyl)methanesulfonyl chloride. With a topological polar surface area (TPSA) of 42.5 Ų, (4-Bromophenyl)methanesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromophenyl)methanesulfonyl 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 (4-Bromophenyl)methanesulfonyl chloride?
The CAS number of (4-Bromophenyl)methanesulfonyl chloride is 53531-69-4.
What is the molecular formula of (4-Bromophenyl)methanesulfonyl chloride?
The molecular formula of (4-Bromophenyl)methanesulfonyl chloride is C7H6BrClO2S.
What is the molecular weight of (4-Bromophenyl)methanesulfonyl chloride?
The molecular weight of (4-Bromophenyl)methanesulfonyl chloride is 267.90 g/mol.
Where can I buy (4-Bromophenyl)methanesulfonyl chloride?
You can request a quote for (4-Bromophenyl)methanesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)methanesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)methanesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.