4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride
TL;DR: 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride (CAS 36835-61-7) is a chemical compound with molecular formula C8H7FN2O5S and molecular weight 262.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetamido-3-nitrobenzenesulfonyl fluoride
Also Known As: starbld0019407, 4-Acetamido-3-nitrobenzene-1-sulfonyl fluoride, 4-acetamido-3-nitrobenzenesulfonyl fluoride, 4-(acetylamino)-3-nitrobenzenesulfonyl fluoride, 3-Nitro-4-acetamidobenzolsulfonylfluorid
| Molecular Formula | C8H7FN2O5S |
|---|---|
| Molecular Weight | 262.01 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.00598 |
| Heavy Atoms | 17 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 36835-61-7 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)F)[N+](=O)[O-] |
| InChIKey | NPBDDLAQXRPFPE-UHFFFAOYSA-N |
Product Overview
4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride (CAS 36835-61-7), with molecular formula C8H7FN2O5S and molecular weight 262.01 g/mol. IUPAC: 4-acetamido-3-nitrobenzenesulfonyl fluoride.
Chemical Property Profile of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride
Property Insights of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride. Following Lipinski's Rule of Five, 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride has 1 hydrogen bond donor(s) and 6 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-(Acetylamino)-3-nitrobenzenesulfonyl fluoride?
The CAS number of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride is 36835-61-7.
What is the molecular formula of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride?
The molecular formula of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride is C8H7FN2O5S.
What is the molecular weight of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride?
The molecular weight of 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride is 262.01 g/mol.
Where can I buy 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride?
You can request a quote for 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 4-(Acetylamino)-3-nitrobenzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.