4-Acetamido-3-nitrobenzenesulfonic acid
TL;DR: 4-Acetamido-3-nitrobenzenesulfonic acid (CAS 159194-76-0) is a chemical compound with molecular formula C8H8N2O6S and molecular weight 260.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetamido-3-nitrobenzenesulfonic acid
Also Known As: 4-acetamido-3-nitrobenzenesulfonic acid, 4-acetamido-3-nitro-benzenesulfonic Acid, 4-acetylamino-3-nitro-benzenesulfonic acid
| Molecular Formula | C8H8N2O6S |
|---|---|
| Molecular Weight | 260.01 g/mol |
| LogP | 0.7999 |
| Topological Polar Surface Area | 126.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.0103 |
| Heavy Atoms | 17 |
| Complexity | 579.6782 |
Chemical Identifiers
| CAS Number | 159194-76-0 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)O)[N+](=O)[O-] |
Product Overview
4-Acetamido-3-nitrobenzenesulfonic acid (CAS 159194-76-0), with molecular formula C8H8N2O6S and molecular weight 260.01 g/mol. IUPAC: 4-acetamido-3-nitrobenzenesulfonic acid.
Chemical Property Profile of 4-Acetamido-3-nitrobenzenesulfonic acid
Property Insights of 4-Acetamido-3-nitrobenzenesulfonic acid
The XLogP value of 0.7999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetamido-3-nitrobenzenesulfonic acid. The TPSA of 126.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetamido-3-nitrobenzenesulfonic acid. Following Lipinski's Rule of Five, 4-Acetamido-3-nitrobenzenesulfonic acid has 2 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 4-Acetamido-3-nitrobenzenesulfonic acid?
The CAS number of 4-Acetamido-3-nitrobenzenesulfonic acid is 159194-76-0.
What is the molecular formula of 4-Acetamido-3-nitrobenzenesulfonic acid?
The molecular formula of 4-Acetamido-3-nitrobenzenesulfonic acid is C8H8N2O6S.
What is the molecular weight of 4-Acetamido-3-nitrobenzenesulfonic acid?
The molecular weight of 4-Acetamido-3-nitrobenzenesulfonic acid is 260.01 g/mol.
Where can I buy 4-Acetamido-3-nitrobenzenesulfonic acid?
You can request a quote for 4-Acetamido-3-nitrobenzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetamido-3-nitrobenzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetamido-3-nitrobenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.