4-(Chlorosulfonyl)-3-nitrobenzoic acid
TL;DR: 4-(Chlorosulfonyl)-3-nitrobenzoic acid (CAS 32571-65-6) is a chemical compound with molecular formula C7H4ClNO6S and molecular weight 264.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chlorosulfonyl-3-nitrobenzoic acid
Also Known As: 4-(chlorosulfonyl)-3-nitrobenzoic acid, 4-chlorosulfonyl-3-nitrobenzoic acid, 4-(chlorosulfonyl)-3-nitrobenzoicacid, 4-chlorosulfonyl-3-nitro-benzoic Acid, Benzoic acid, 4-(chlorosulfonyl)-3-nitro-
| Molecular Formula | C7H4ClNO6S |
|---|---|
| Molecular Weight | 264.94 g/mol |
| LogP | 1.2205 |
| Topological Polar Surface Area | 114.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.9448 |
| Heavy Atoms | 16 |
| Complexity | 566.2398 |
Chemical Identifiers
| CAS Number | 32571-65-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])S(=O)(=O)Cl |
Product Overview
4-(Chlorosulfonyl)-3-nitrobenzoic acid (CAS 32571-65-6), with molecular formula C7H4ClNO6S and molecular weight 264.94 g/mol. IUPAC: 4-chlorosulfonyl-3-nitrobenzoic acid.
Chemical Property Profile of 4-(Chlorosulfonyl)-3-nitrobenzoic acid
Property Insights of 4-(Chlorosulfonyl)-3-nitrobenzoic acid
The XLogP value of 1.2205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Chlorosulfonyl)-3-nitrobenzoic acid. The TPSA of 114.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Chlorosulfonyl)-3-nitrobenzoic acid. Following Lipinski's Rule of Five, 4-(Chlorosulfonyl)-3-nitrobenzoic acid has 1 hydrogen bond donor(s) and 5 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-(Chlorosulfonyl)-3-nitrobenzoic acid?
The CAS number of 4-(Chlorosulfonyl)-3-nitrobenzoic acid is 32571-65-6.
What is the molecular formula of 4-(Chlorosulfonyl)-3-nitrobenzoic acid?
The molecular formula of 4-(Chlorosulfonyl)-3-nitrobenzoic acid is C7H4ClNO6S.
What is the molecular weight of 4-(Chlorosulfonyl)-3-nitrobenzoic acid?
The molecular weight of 4-(Chlorosulfonyl)-3-nitrobenzoic acid is 264.94 g/mol.
Where can I buy 4-(Chlorosulfonyl)-3-nitrobenzoic acid?
You can request a quote for 4-(Chlorosulfonyl)-3-nitrobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Chlorosulfonyl)-3-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chlorosulfonyl)-3-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.