1-Methyl-3-(4-nitrophenyl)-1-triazene
TL;DR: 1-Methyl-3-(4-nitrophenyl)-1-triazene (CAS 40643-39-8) is a chemical compound with molecular formula C7H8N4O2 and molecular weight 180.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(methyldiazenyl)-4-nitroaniline
Also Known As: 3-Methyl-1- triazene, N-(methyldiazenyl)-4-nitroaniline, Triazene, 3-methyl-1-(p-nitrophenyl)-, 1-(4-Nitrophenyl)-3-methyltriazene, 3-Methyl-1-(4-nitrophenyl)triazene
| Molecular Formula | C7H8N4O2 |
|---|---|
| Molecular Weight | 180.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.06473 |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 40643-39-8 |
|---|---|
| SMILES | CN=NNC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | BDSNQOSDUXHMCI-UHFFFAOYSA-N |
Product Overview
1-Methyl-3-(4-nitrophenyl)-1-triazene (CAS 40643-39-8), with molecular formula C7H8N4O2 and molecular weight 180.06 g/mol. IUPAC: N-(methyldiazenyl)-4-nitroaniline.
Chemical Property Profile of 1-Methyl-3-(4-nitrophenyl)-1-triazene
Property Insights of 1-Methyl-3-(4-nitrophenyl)-1-triazene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-(4-nitrophenyl)-1-triazene. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-3-(4-nitrophenyl)-1-triazene. Following Lipinski's Rule of Five, 1-Methyl-3-(4-nitrophenyl)-1-triazene has 1 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 1-Methyl-3-(4-nitrophenyl)-1-triazene?
The CAS number of 1-Methyl-3-(4-nitrophenyl)-1-triazene is 40643-39-8.
What is the molecular formula of 1-Methyl-3-(4-nitrophenyl)-1-triazene?
The molecular formula of 1-Methyl-3-(4-nitrophenyl)-1-triazene is C7H8N4O2.
What is the molecular weight of 1-Methyl-3-(4-nitrophenyl)-1-triazene?
The molecular weight of 1-Methyl-3-(4-nitrophenyl)-1-triazene is 180.06 g/mol.
Where can I buy 1-Methyl-3-(4-nitrophenyl)-1-triazene?
You can request a quote for 1-Methyl-3-(4-nitrophenyl)-1-triazene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-(4-nitrophenyl)-1-triazene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-(4-nitrophenyl)-1-triazene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.