2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid
TL;DR: 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid (CAS 97675-34-8) is a chemical compound with molecular formula C12H11N3O5S and molecular weight 309.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminoanilino)-5-nitrobenzenesulfonic acid
Also Known As: Aniline Nitro Nerol Acid, H-Ile-OAll.TosOH, 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid, 2-(4-aminoanilino)-5-nitrobenzenesulfonic acid, Benzenesulfonic acid, 2-[(4-aminophenyl)amino]-5-nitro-
| Molecular Formula | C12H11N3O5S |
|---|---|
| Molecular Weight | 309.04 g/mol |
| LogP | 2.1673 |
| Topological Polar Surface Area | 135.56 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.04193 |
| Heavy Atoms | 21 |
| Complexity | 787.0402 |
Chemical Identifiers
| CAS Number | 97675-34-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O |
Product Overview
2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid (CAS 97675-34-8), with molecular formula C12H11N3O5S and molecular weight 309.04 g/mol. IUPAC: 2-(4-aminoanilino)-5-nitrobenzenesulfonic acid.
Chemical Property Profile of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid
Property Insights of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid
The XLogP value of 2.1673 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid. The TPSA of 135.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid. Following Lipinski's Rule of Five, 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid has 3 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 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid?
The CAS number of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid is 97675-34-8.
What is the molecular formula of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid?
The molecular formula of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid is C12H11N3O5S.
What is the molecular weight of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid?
The molecular weight of 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid is 309.04 g/mol.
Where can I buy 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid?
You can request a quote for 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Aminoanilino)-5-nitrobenzenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.