Sodium 4-chloro-3-nitrobenzenesulfinate
TL;DR: Sodium 4-chloro-3-nitrobenzenesulfinate (CAS 80917-26-6) is a chemical compound with molecular formula C6H3ClNNaO4S and molecular weight 242.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 4-chloro-3-nitrobenzenesulfinate
Also Known As: sodium 4-chloro-3-nitrobenzenesulfinate, [(4-chloro-3-nitrophenyl)sulfonyl]sodium, [(4-chloro-3-nitrobenzene)sulfonyl]sodium, Sodium 1-chloro-2-nitro-4-sulfinato-benzene
| Molecular Formula | C6H3ClNNaO4S |
|---|---|
| Molecular Weight | 242.94 g/mol |
| LogP | -1.5098 |
| Topological Polar Surface Area | 83.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.9369 |
| Heavy Atoms | 14 |
| Complexity | 386.0943 |
Chemical Identifiers
| CAS Number | 80917-26-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)[O-])[N+](=O)[O-])Cl.[Na+] |
Product Overview
Sodium 4-chloro-3-nitrobenzenesulfinate (CAS 80917-26-6), with molecular formula C6H3ClNNaO4S and molecular weight 242.94 g/mol. IUPAC: sodium 4-chloro-3-nitrobenzenesulfinate.
Chemical Property Profile of Sodium 4-chloro-3-nitrobenzenesulfinate
Property Insights of Sodium 4-chloro-3-nitrobenzenesulfinate
The XLogP value of -1.5098 indicates that Sodium 4-chloro-3-nitrobenzenesulfinate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.27 Ų falls within the moderate polarity range, balancing permeability and solubility for Sodium 4-chloro-3-nitrobenzenesulfinate. Following Lipinski's Rule of Five, Sodium 4-chloro-3-nitrobenzenesulfinate has 0 hydrogen bond donor(s) and 4 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 Sodium 4-chloro-3-nitrobenzenesulfinate?
The CAS number of Sodium 4-chloro-3-nitrobenzenesulfinate is 80917-26-6.
What is the molecular formula of Sodium 4-chloro-3-nitrobenzenesulfinate?
The molecular formula of Sodium 4-chloro-3-nitrobenzenesulfinate is C6H3ClNNaO4S.
What is the molecular weight of Sodium 4-chloro-3-nitrobenzenesulfinate?
The molecular weight of Sodium 4-chloro-3-nitrobenzenesulfinate is 242.94 g/mol.
Where can I buy Sodium 4-chloro-3-nitrobenzenesulfinate?
You can request a quote for Sodium 4-chloro-3-nitrobenzenesulfinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium 4-chloro-3-nitrobenzenesulfinate?
Yes, KEHONG BIO provides custom synthesis services for Sodium 4-chloro-3-nitrobenzenesulfinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.