2,2',4,4'-Tetranitrodiphenylamine
TL;DR: 2,2',4,4'-Tetranitrodiphenylamine (CAS 2908-76-1) is a chemical compound with molecular formula C12H7N5O8 and molecular weight 349.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dinitrophenyl)-2,4-dinitroaniline
Also Known As: N-(2,4-Dinitrophenyl)-2,4-dinitroaniline, Bis-(2:4-dinitrophenyl)amine, 2,2',4,4'-Tetranitrodiphenylamine, Bis(2,4-dinitrophenyl)amine, N- -2,4-dinitroaniline
| Molecular Formula | C12H7N5O8 |
|---|---|
| Molecular Weight | 349.03 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.02945 |
| Heavy Atoms | 25 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 2908-76-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | UHWJMXASZSKFEO-UHFFFAOYSA-N |
Product Overview
2,2',4,4'-Tetranitrodiphenylamine (CAS 2908-76-1), with molecular formula C12H7N5O8 and molecular weight 349.03 g/mol. IUPAC: N-(2,4-dinitrophenyl)-2,4-dinitroaniline.
Chemical Property Profile of 2,2',4,4'-Tetranitrodiphenylamine
Property Insights of 2,2',4,4'-Tetranitrodiphenylamine
The XLogP value of 3.3 indicates that 2,2',4,4'-Tetranitrodiphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 195.0 Ų indicates high polarity, suggesting 2,2',4,4'-Tetranitrodiphenylamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2',4,4'-Tetranitrodiphenylamine has 1 hydrogen bond donor(s) and 9 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 2,2',4,4'-Tetranitrodiphenylamine?
The CAS number of 2,2',4,4'-Tetranitrodiphenylamine is 2908-76-1.
What is the molecular formula of 2,2',4,4'-Tetranitrodiphenylamine?
The molecular formula of 2,2',4,4'-Tetranitrodiphenylamine is C12H7N5O8.
What is the molecular weight of 2,2',4,4'-Tetranitrodiphenylamine?
The molecular weight of 2,2',4,4'-Tetranitrodiphenylamine is 349.03 g/mol.
Where can I buy 2,2',4,4'-Tetranitrodiphenylamine?
You can request a quote for 2,2',4,4'-Tetranitrodiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2',4,4'-Tetranitrodiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for 2,2',4,4'-Tetranitrodiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.