4-Amino-2-nitrodiphenylamine
TL;DR: 4-Amino-2-nitrodiphenylamine (CAS 2784-89-6) is a chemical compound with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-1-N-phenylbenzene-1,4-diamine
Also Known As: 2-Nitro-4-aminodiphenylamine, HC Red no. 1, 1,4-Benzenediamine, 2-nitro-N1-phenyl-, null, 4-Amino-2-nitrodiphenylamine
| Molecular Formula | C12H11N3O2 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 2.9206 |
| Topological Polar Surface Area | 81.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.08513 |
| Heavy Atoms | 17 |
| Complexity | 540.7019 |
Chemical Identifiers
| CAS Number | 2784-89-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)[N+](=O)[O-] |
Product Overview
4-Amino-2-nitrodiphenylamine (CAS 2784-89-6), with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol. IUPAC: 2-nitro-1-N-phenylbenzene-1,4-diamine.
Chemical Property Profile of 4-Amino-2-nitrodiphenylamine
Property Insights of 4-Amino-2-nitrodiphenylamine
The XLogP value of 2.9206 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-2-nitrodiphenylamine. The TPSA of 81.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-2-nitrodiphenylamine. Following Lipinski's Rule of Five, 4-Amino-2-nitrodiphenylamine 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
Frequently Asked Questions
What is the CAS number of 4-Amino-2-nitrodiphenylamine?
The CAS number of 4-Amino-2-nitrodiphenylamine is 2784-89-6.
What is the molecular formula of 4-Amino-2-nitrodiphenylamine?
The molecular formula of 4-Amino-2-nitrodiphenylamine is C12H11N3O2.
What is the molecular weight of 4-Amino-2-nitrodiphenylamine?
The molecular weight of 4-Amino-2-nitrodiphenylamine is 229.09 g/mol.
Where can I buy 4-Amino-2-nitrodiphenylamine?
You can request a quote for 4-Amino-2-nitrodiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-2-nitrodiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2-nitrodiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.