Diphenylamine-4-sulfonic acid
TL;DR: Diphenylamine-4-sulfonic acid (CAS 101-57-5) is a chemical compound with molecular formula C12H11NO3S and molecular weight 249.04596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-anilinobenzenesulfonic acid
Also Known As: Sulfodiphenylamine, 4-Sulfodiphenylamine, 4-Anilinobenzenesulfonic acid, Diphenylamine Sulfonic Acid, Diphenylamine-4-sulfonic acid
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H11NO3S |
| Molecular Weight | 249.04596 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.04596 Da |
| Heavy Atoms | 17 |
| Complexity | 322.0 |
| SMILES | C1=CC=C(C=C1)NC2=CC=C(C=C2)S(=O)(=O)O |
| InChIKey | HYKDWGUFDOYDGV-UHFFFAOYSA-N |
Chemical Property Profile of Diphenylamine-4-sulfonic acid
Property Insights of Diphenylamine-4-sulfonic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diphenylamine-4-sulfonic acid. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenylamine-4-sulfonic acid. Following Lipinski's Rule of Five, Diphenylamine-4-sulfonic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diphenylamine-4-sulfonic acid?
The CAS number of Diphenylamine-4-sulfonic acid is 101-57-5.
What is the molecular formula of Diphenylamine-4-sulfonic acid?
The molecular formula of Diphenylamine-4-sulfonic acid is C12H11NO3S.
What is the molecular weight of Diphenylamine-4-sulfonic acid?
The molecular weight of Diphenylamine-4-sulfonic acid is 249.04596 g/mol.
Where can I buy Diphenylamine-4-sulfonic acid?
You can request a quote for Diphenylamine-4-sulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diphenylamine-4-sulfonic acid?
Yes, CoreyChem provides custom synthesis services for Diphenylamine-4-sulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.