N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine
TL;DR: N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine (CAS 2045-64-9) is a chemical compound with molecular formula C14H14N4O4 and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-(2,4-dinitrophenyl)-4-N,4-N-dimethylbenzene-1,4-diamine
Also Known As: J1.429.761H, N,N-DIMETHYL-N'-(2,4-DINITROPHENYL)-1,4-PHENYLENEDIAMINE, 1,4-Benzenediamine, N'-(2,4-dinitrophenyl)-N,N-dimethyl-, 1-N-(2,4-dinitrophenyl)-4-N,4-N-dimethylbenzene-1,4-diamine, N,N-Dimethyl-N'-<2,4-dinitro-phenyl>-p-phenylendiamin
| Molecular Formula | C14H14N4O4 |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 3.3126 |
| Topological Polar Surface Area | 101.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.1015 |
| Heavy Atoms | 22 |
| Complexity | 713.28284 |
Chemical Identifiers
| CAS Number | 2045-64-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine (CAS 2045-64-9), with molecular formula C14H14N4O4 and molecular weight 302.10 g/mol. IUPAC: 1-N-(2,4-dinitrophenyl)-4-N,4-N-dimethylbenzene-1,4-diamine.
Chemical Property Profile of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine
Property Insights of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine
The XLogP value of 3.3126 indicates that N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine. Following Lipinski's Rule of Five, N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine has 1 hydrogen bond donor(s) and 6 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,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine?
The CAS number of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine is 2045-64-9.
What is the molecular formula of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine?
The molecular formula of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine is C14H14N4O4.
What is the molecular weight of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine?
The molecular weight of N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine is 302.10 g/mol.
Where can I buy N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine?
You can request a quote for N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-N'-(2,4-dinitrophenyl)-1,4-phenylenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.