4-Nitrobenzenesulfonyl chloride
TL;DR: 4-Nitrobenzenesulfonyl chloride (CAS 98-74-8) is a chemical compound with molecular formula C6H4ClNO4S and molecular weight 220.95496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-nitrobenzenesulfonyl chloride
Also Known As: 4-Nitrobenzenesulfonyl chloride, nosylchloride, null, 4-nitrobenzene-1-sulfonyl chloride, Nosyl chloride
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H4ClNO4S |
| Molecular Weight | 220.95496 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.95496 Da |
| Heavy Atoms | 13 |
| Complexity | 283.0 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)Cl |
| InChIKey | JXRGUPLJCCDGKG-UHFFFAOYSA-N |
Product Description
Applications: 4-Nitrobenzenesulfonyl chloride is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A heterocyclic building block supplied by CoreyChem, 4-Nitrobenzenesulfonyl chloride (CAS 98-74-8) has the molecular formula C6H4ClNO4S and a molecular weight of 220.95 g/mol. Synonyms include 4-Nitrobenzenesulfonyl chloride and nosylchloride.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Nitrobenzenesulfonyl chloride
Property Insights of 4-Nitrobenzenesulfonyl chloride
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrobenzenesulfonyl chloride. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrobenzenesulfonyl chloride. Following Lipinski's Rule of Five, 4-Nitrobenzenesulfonyl 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
What is the CAS number of 4-Nitrobenzenesulfonyl chloride?
The CAS number of 4-Nitrobenzenesulfonyl chloride is 98-74-8.
What is the molecular formula of 4-Nitrobenzenesulfonyl chloride?
The molecular formula of 4-Nitrobenzenesulfonyl chloride is C6H4ClNO4S.
What is the molecular weight of 4-Nitrobenzenesulfonyl chloride?
The molecular weight of 4-Nitrobenzenesulfonyl chloride is 220.95496 g/mol.
What are the applications of 4-Nitrobenzenesulfonyl chloride?
4-Nitrobenzenesulfonyl chloride is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog...
Where can I buy 4-Nitrobenzenesulfonyl chloride?
You can request a quote for 4-Nitrobenzenesulfonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Nitrobenzenesulfonyl chloride?
Yes, CoreyChem provides custom synthesis services for 4-Nitrobenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.