Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-
TL;DR: Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- (CAS 294649-28-8) is a chemical compound with molecular formula C14H11N3O4 and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-5-nitrophenyl)-1-(3-nitrophenyl)methanimine
Also Known As: (2-methyl-5-nitrophenyl)(3-nitrobenzylidene)amine, 2-methyl-5-nitro-N-(3-nitrobenzylidene)aniline, Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-, A0841/0039451, N-(2-methyl-5-nitrophenyl)-1-(3-nitrophenyl)methanimine
| Molecular Formula | C14H11N3O4 |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.07495 |
| Heavy Atoms | 21 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 294649-28-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])N=CC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | XAPLJGILHAMKAX-UHFFFAOYSA-N |
Product Overview
Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- (CAS 294649-28-8), with molecular formula C14H11N3O4 and molecular weight 285.07 g/mol. IUPAC: N-(2-methyl-5-nitrophenyl)-1-(3-nitrophenyl)methanimine.
Chemical Property Profile of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-
Property Insights of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-
The XLogP value of 3.2 indicates that Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-. Following Lipinski's Rule of Five, Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- has 0 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 Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-?
The CAS number of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- is 294649-28-8.
What is the molecular formula of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-?
The molecular formula of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- is C14H11N3O4.
What is the molecular weight of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-?
The molecular weight of Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- is 285.07 g/mol.
Where can I buy Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-?
You can request a quote for Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methyl-4-nitro-2-(3-nitrobenzylidenamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.