4-Nitrostyrylsulfonyl chloride
TL;DR: 4-Nitrostyrylsulfonyl chloride (CAS 7506-63-0) is a chemical compound with molecular formula C8H6ClNO4S and molecular weight 246.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)ethenesulfonyl chloride
Also Known As: 4-nitrostyrylsulfonyl chloride, 2-(4-nitrophenyl)ethenesulfonyl chloride, Ethenesulfonylchloride, 2-(4-nitrophenyl)-, 2-(4-Nitrophenyl)ethene-1-sulfonyl chloride, (E)-2-(4-nitrophenyl)ethenesulfonyl chloride
| Molecular Formula | C8H6ClNO4S |
|---|---|
| Molecular Weight | 246.97 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.97061 |
| Heavy Atoms | 15 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 7506-63-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CS(=O)(=O)Cl)[N+](=O)[O-] |
| InChIKey | SVMBRAHBRXXFEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Nitrostyrylsulfonyl chloride (CAS 7506-63-0), with molecular formula C8H6ClNO4S and molecular weight 246.97 g/mol. IUPAC: 2-(4-nitrophenyl)ethenesulfonyl chloride.
Chemical Property Profile of 4-Nitrostyrylsulfonyl chloride
Property Insights of 4-Nitrostyrylsulfonyl chloride
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrostyrylsulfonyl chloride. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrostyrylsulfonyl chloride. Following Lipinski's Rule of Five, 4-Nitrostyrylsulfonyl chloride 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 4-Nitrostyrylsulfonyl chloride?
The CAS number of 4-Nitrostyrylsulfonyl chloride is 7506-63-0.
What is the molecular formula of 4-Nitrostyrylsulfonyl chloride?
The molecular formula of 4-Nitrostyrylsulfonyl chloride is C8H6ClNO4S.
What is the molecular weight of 4-Nitrostyrylsulfonyl chloride?
The molecular weight of 4-Nitrostyrylsulfonyl chloride is 246.97 g/mol.
Where can I buy 4-Nitrostyrylsulfonyl chloride?
You can request a quote for 4-Nitrostyrylsulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrostyrylsulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrostyrylsulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.