N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline
TL;DR: N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline (CAS 21565-22-0) is a chemical compound with molecular formula C12H6N6O10 and molecular weight 394.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dinitrophenyl)-2,4,6-trinitroaniline
Also Known As: N- -2,4,6-trinitroaniline, N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline, (2,4-dinitrophenyl)(2,4,6-trinitrophenyl)amine, N-(2,4-Dinitrophenyl)-2,4,6-trinitrobenzenamine, Benzenamine,N-(2,4-dinitrophenyl)-2,4,6-trinitro-
| Molecular Formula | C12H6N6O10 |
|---|---|
| Molecular Weight | 394.01 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 241.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 394.01453 |
| Heavy Atoms | 28 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 21565-22-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | VSGCEWSTFLCCNI-UHFFFAOYSA-N |
Product Overview
N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline (CAS 21565-22-0), with molecular formula C12H6N6O10 and molecular weight 394.01 g/mol. IUPAC: N-(2,4-dinitrophenyl)-2,4,6-trinitroaniline.
Chemical Property Profile of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline
Property Insights of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline
The XLogP value of 3.3 indicates that N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 241.0 Ų indicates high polarity, suggesting N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline?
The CAS number of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline is 21565-22-0.
What is the molecular formula of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline?
The molecular formula of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline is C12H6N6O10.
What is the molecular weight of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline?
The molecular weight of N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline is 394.01 g/mol.
Where can I buy N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline?
You can request a quote for N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dinitrophenyl)-2,4,6-trinitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.