间溴苯磺酰氯
TL;DR: 间溴苯磺酰氯 (CAS 2905-24-0) 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.
间溴苯磺酰氯
3-bromobenzenesulfonyl chloride
Also Known As: 3-Bromobenzenesulfonyl chloride, 3-bromobenzene-1-sulfonyl chloride, 3-Bromobenzenesulphonyl Chloride, Benzenesulfonyl chloride, 3-bromo-, 3-bromobenzenesulfonylchloride
| Molecular Formula | C6H4BrClO2S |
|---|---|
| Molecular Weight | 253.88 g/mol |
| LogP | 2.8 |
| 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 | 2905-24-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)S(=O)(=O)Cl |
| InChIKey | PJGOLCXVWIYXRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
间溴苯磺酰氯 (CAS 2905-24-0), with molecular formula C6H4BrClO2S and molecular weight 253.88 g/mol. IUPAC: 3-bromobenzenesulfonyl chloride.
Chemical Property Profile of 间溴苯磺酰氯
Property Insights of 间溴苯磺酰氯
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 间溴苯磺酰氯. With a topological polar surface area (TPSA) of 42.5 Ų, 间溴苯磺酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 间溴苯磺酰氯 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 间溴苯磺酰氯?
The CAS number of 间溴苯磺酰氯 is 2905-24-0.
What is the molecular formula of 间溴苯磺酰氯?
The molecular formula of 间溴苯磺酰氯 is C6H4BrClO2S.
What is the molecular weight of 间溴苯磺酰氯?
The molecular weight of 间溴苯磺酰氯 is 253.88 g/mol.
Where can I buy 间溴苯磺酰氯?
You can request a quote for 间溴苯磺酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 间溴苯磺酰氯?
Yes, KEHONG BIO provides custom synthesis services for 间溴苯磺酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.