Benzenesulfonic acid, 5-(acetylamino)-2-amino-
TL;DR: Benzenesulfonic acid, 5-(acetylamino)-2-amino- (CAS 96-78-6) is a chemical compound with molecular formula C8H10N2O4S and molecular weight 230.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetamido-2-aminobenzenesulfonic acid
Also Known As: 4-Aminoacetanilide-3-sulfonic acid, 5-Acetamido-2-aminobenzenesulfonic acid, 3-Nitrophthalicanhydride, 5-acetamidoorthanilic acid, 4-Aminoacetanilide-3-sulfonicacid
| Molecular Formula | C8H10N2O4S |
|---|---|
| Molecular Weight | 230.04 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.03613 |
| Heavy Atoms | 15 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 96-78-6 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)N)S(=O)(=O)O |
| InChIKey | PHRVJZNHPVJYOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenesulfonic acid, 5-(acetylamino)-2-amino- (CAS 96-78-6), with molecular formula C8H10N2O4S and molecular weight 230.04 g/mol. IUPAC: 5-acetamido-2-aminobenzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, 5-(acetylamino)-2-amino-
Property Insights of Benzenesulfonic acid, 5-(acetylamino)-2-amino-
The XLogP value of -0.3 indicates that Benzenesulfonic acid, 5-(acetylamino)-2-amino- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, 5-(acetylamino)-2-amino-. Following Lipinski's Rule of Five, Benzenesulfonic acid, 5-(acetylamino)-2-amino- has 3 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 Benzenesulfonic acid, 5-(acetylamino)-2-amino-?
The CAS number of Benzenesulfonic acid, 5-(acetylamino)-2-amino- is 96-78-6.
What is the molecular formula of Benzenesulfonic acid, 5-(acetylamino)-2-amino-?
The molecular formula of Benzenesulfonic acid, 5-(acetylamino)-2-amino- is C8H10N2O4S.
What is the molecular weight of Benzenesulfonic acid, 5-(acetylamino)-2-amino-?
The molecular weight of Benzenesulfonic acid, 5-(acetylamino)-2-amino- is 230.04 g/mol.
Where can I buy Benzenesulfonic acid, 5-(acetylamino)-2-amino-?
You can request a quote for Benzenesulfonic acid, 5-(acetylamino)-2-amino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 5-(acetylamino)-2-amino-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 5-(acetylamino)-2-amino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.