![N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline structure](/static/products/6731/6731-01-7.webp)
N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline
TL;DR: N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline (CAS 6731-01-7) is a chemical compound with molecular formula C18H11N5O9 and molecular weight 441.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline
Also Known As: N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline, 2,4-Dinitro-4'-(2,4-Dinitrophenoxy)Diphenylamine, RefChem:357106
| Molecular Formula | C18H11N5O9 |
|---|---|
| Molecular Weight | 441.06 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 205.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 441.05566 |
| Heavy Atoms | 32 |
| Complexity | 708.0 |
Chemical Identifiers
| CAS Number | 6731-01-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CMNWVSMJEYBPCQ-UHFFFAOYSA-N |
Product Overview
N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline (CAS 6731-01-7), with molecular formula C18H11N5O9 and molecular weight 441.06 g/mol. IUPAC: N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline.
Chemical Property Profile of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline
Property Insights of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline
The XLogP value of 4.9 indicates that N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 205.0 Ų indicates high polarity, suggesting N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline has 1 hydrogen bond donor(s) and 10 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-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline?
The CAS number of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline is 6731-01-7.
What is the molecular formula of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline?
The molecular formula of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline is C18H11N5O9.
What is the molecular weight of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline?
The molecular weight of N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline is 441.06 g/mol.
Where can I buy N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline?
You can request a quote for N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(2,4-dinitrophenoxy)phenyl]-2,4-dinitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.