2-Bromo-5-(chlorosulfonyl)benzoic acid
TL;DR: 2-Bromo-5-(chlorosulfonyl)benzoic acid (CAS 3285-31-2) is a chemical compound with molecular formula C7H4BrClO4S and molecular weight 297.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-5-chlorosulfonylbenzoic acid
Also Known As: 2-Bromo-5-(chlorosulfonyl)benzoic acid, 2-bromo-5-chlorosulfonyl-benzoic Acid, 2-bromo-5-chlorosulfonylbenzoic acid, 2-Bromo-5-(chlorosulfonyl) benzoic acid, 2-Bromo-5-(chlorosulfonyl)benzoicacid
| Molecular Formula | C7H4BrClO4S |
|---|---|
| Molecular Weight | 297.87 g/mol |
| LogP | 2.0748 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.8702 |
| Heavy Atoms | 14 |
| Complexity | 482.4632 |
Chemical Identifiers
| CAS Number | 3285-31-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)Cl)C(=O)O)Br |
Product Overview
2-Bromo-5-(chlorosulfonyl)benzoic acid (CAS 3285-31-2), with molecular formula C7H4BrClO4S and molecular weight 297.87 g/mol. IUPAC: 2-bromo-5-chlorosulfonylbenzoic acid.
Chemical Property Profile of 2-Bromo-5-(chlorosulfonyl)benzoic acid
Property Insights of 2-Bromo-5-(chlorosulfonyl)benzoic acid
The XLogP value of 2.0748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-5-(chlorosulfonyl)benzoic acid. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-5-(chlorosulfonyl)benzoic acid. Following Lipinski's Rule of Five, 2-Bromo-5-(chlorosulfonyl)benzoic acid has 1 hydrogen bond donor(s) and 3 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-Bromo-5-(chlorosulfonyl)benzoic acid?
The CAS number of 2-Bromo-5-(chlorosulfonyl)benzoic acid is 3285-31-2.
What is the molecular formula of 2-Bromo-5-(chlorosulfonyl)benzoic acid?
The molecular formula of 2-Bromo-5-(chlorosulfonyl)benzoic acid is C7H4BrClO4S.
What is the molecular weight of 2-Bromo-5-(chlorosulfonyl)benzoic acid?
The molecular weight of 2-Bromo-5-(chlorosulfonyl)benzoic acid is 297.87 g/mol.
Where can I buy 2-Bromo-5-(chlorosulfonyl)benzoic acid?
You can request a quote for 2-Bromo-5-(chlorosulfonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-5-(chlorosulfonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-5-(chlorosulfonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.