N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine
TL;DR: N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine (CAS 10173-60-1) is a chemical compound with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-nitrophenyl)methylideneamino]aniline
Also Known As: N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine, 2-[(2-nitrophenyl)methylideneamino]aniline, (1E)-N1-[(2-nitrophenyl)methylidene]benzene-1,2-diamine, J3.085.561B, N-(2-Aminophenyl)-2-nitrobenzenemethaneimine
| Molecular Formula | C13H11N3O2 |
|---|---|
| Molecular Weight | 241.09 g/mol |
| LogP | 2.9276 |
| Topological Polar Surface Area | 81.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.08513 |
| Heavy Atoms | 18 |
| Complexity | 608.6903 |
Chemical Identifiers
| CAS Number | 10173-60-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NC2=CC=CC=C2N)[N+](=O)[O-] |
Product Overview
N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine (CAS 10173-60-1), with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol. IUPAC: 2-[(2-nitrophenyl)methylideneamino]aniline.
Chemical Property Profile of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine
Property Insights of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine
The XLogP value of 2.9276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine. The TPSA of 81.52 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine. Following Lipinski's Rule of Five, N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine has 1 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 N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine?
The CAS number of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine is 10173-60-1.
What is the molecular formula of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine?
The molecular formula of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine is C13H11N3O2.
What is the molecular weight of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine?
The molecular weight of N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine is 241.09 g/mol.
Where can I buy N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine?
You can request a quote for N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine?
Yes, KEHONG BIO provides custom synthesis services for N~1~-[(2-nitrophenyl)methylene]-1,2-benzenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.