Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-
TL;DR: Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- (CAS 117907-43-4) is a chemical compound with molecular formula C13H11N3O4 and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-amino-2-nitroanilino)benzoic acid
Also Known As: 4-Amino-2-nitrodiphenylamine-2'-carboxylic acid, 2-((4-Amino-2-nitrophenyl)amino)benzoic acid, 2-(4-amino-2-nitroanilino)benzoic acid, Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-, 4-Amino-2-Nitrodiphenylamine-2-Carboxylic acid
| Molecular Formula | C13H11N3O4 |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | 2.6188 |
| Topological Polar Surface Area | 118.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.07495 |
| Heavy Atoms | 20 |
| Complexity | 685.0665 |
Chemical Identifiers
| CAS Number | 117907-43-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=C(C=C(C=C2)N)[N+](=O)[O-] |
Product Overview
Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- (CAS 117907-43-4), with molecular formula C13H11N3O4 and molecular weight 273.07 g/mol. IUPAC: 2-(4-amino-2-nitroanilino)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-
Property Insights of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-
The XLogP value of 2.6188 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-. The TPSA of 118.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-. Following Lipinski's Rule of Five, Benzoic acid, 2-((4-amino-2-nitrophenyl)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 Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-?
The CAS number of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- is 117907-43-4.
What is the molecular formula of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-?
The molecular formula of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- is C13H11N3O4.
What is the molecular weight of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-?
The molecular weight of Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- is 273.07 g/mol.
Where can I buy Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-?
You can request a quote for Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((4-amino-2-nitrophenyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.