2-Nitrobenzenesulfonyl fluoride
TL;DR: 2-Nitrobenzenesulfonyl fluoride (CAS 433-98-7) is a chemical compound with molecular formula C6H4FNO4S and molecular weight 204.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrobenzenesulfonyl fluoride
Also Known As: 2-Nitrobenzenesulfonyl fluoride, 2-Nitrobenzene-1-sulfonyl fluoride, 2-Nitrobenzenesulphonyl fluoride, 2-Nitro-benzenesulfonyl fluoride, NBSF cpd
| Molecular Formula | C6H4FNO4S |
|---|---|
| Molecular Weight | 204.98 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.98451 |
| Heavy Atoms | 13 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 433-98-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)F |
| InChIKey | HSQIQAVSSNKMBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Nitrobenzenesulfonyl fluoride (CAS 433-98-7), with molecular formula C6H4FNO4S and molecular weight 204.98 g/mol. IUPAC: 2-nitrobenzenesulfonyl fluoride.
Chemical Property Profile of 2-Nitrobenzenesulfonyl fluoride
Property Insights of 2-Nitrobenzenesulfonyl fluoride
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitrobenzenesulfonyl fluoride. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrobenzenesulfonyl fluoride. Following Lipinski's Rule of Five, 2-Nitrobenzenesulfonyl fluoride has 0 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 2-Nitrobenzenesulfonyl fluoride?
The CAS number of 2-Nitrobenzenesulfonyl fluoride is 433-98-7.
What is the molecular formula of 2-Nitrobenzenesulfonyl fluoride?
The molecular formula of 2-Nitrobenzenesulfonyl fluoride is C6H4FNO4S.
What is the molecular weight of 2-Nitrobenzenesulfonyl fluoride?
The molecular weight of 2-Nitrobenzenesulfonyl fluoride is 204.98 g/mol.
Where can I buy 2-Nitrobenzenesulfonyl fluoride?
You can request a quote for 2-Nitrobenzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrobenzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrobenzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.