4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid
TL;DR: 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid (CAS 135-11-5) is a chemical compound with molecular formula C12H11N3O5S and molecular weight 309.04193 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-aminoanilino)-3-nitrobenzenesulfonic acid
Also Known As: 4-(4-aminoanilino)-3-nitrobenzenesulfonic acid, 4-(4-Aminoanilino)-3-nitrobenzenesulphonic acid, 4-(mercaptomethyl)benzoicacid, EINECS 205-175-9, 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid
Technical Specifications
| Molecular Formula | C12H11N3O5S |
| Molecular Weight | 309.04193 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.04193 Da |
| Heavy Atoms | 21 |
| Complexity | 464.0 |
| SMILES | C1=CC(=CC=C1N)NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-] |
| InChIKey | IQXPRPSTZKBYER-UHFFFAOYSA-N |
Chemical Property Profile of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid
Property Insights of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid. The TPSA of 147.0 Ų indicates high polarity, suggesting 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid?
The CAS number of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid is 135-11-5.
What is the molecular formula of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid?
The molecular formula of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid is C12H11N3O5S.
What is the molecular weight of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid?
The molecular weight of 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid is 309.04193 g/mol.
Where can I buy 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid?
You can request a quote for 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid?
Yes, CoreyChem provides custom synthesis services for 4-(p-Aminoanilino)-3-nitrobenzenesulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.