2-(4-Nitrophenyl)-2h-1,2,3-triazole
TL;DR: 2-(4-Nitrophenyl)-2h-1,2,3-triazole (CAS 18922-72-0) is a chemical compound with molecular formula C8H6N4O2 and molecular weight 190.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)triazole
Also Known As: 2-(4-nitrophenyl)-2h-1,2,3-triazole, 2-(4-nitrophenyl)triazole, 2H-1,2,3-Triazole, 2-(4-nitrophenyl)-, 2-(4-nitrophenyl)-1,2,3-triazole, 2-(4-Nitrophenyl)-2H-123-triazole
| Molecular Formula | C8H6N4O2 |
|---|---|
| Molecular Weight | 190.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 76.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.04907 |
| Heavy Atoms | 14 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 18922-72-0 |
|---|---|
| SMILES | C1=CC(=CC=C1N2N=CC=N2)[N+](=O)[O-] |
| InChIKey | DAIISCIHCDYWAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Nitrophenyl)-2h-1,2,3-triazole (CAS 18922-72-0), with molecular formula C8H6N4O2 and molecular weight 190.05 g/mol. IUPAC: 2-(4-nitrophenyl)triazole.
Chemical Property Profile of 2-(4-Nitrophenyl)-2h-1,2,3-triazole
Property Insights of 2-(4-Nitrophenyl)-2h-1,2,3-triazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Nitrophenyl)-2h-1,2,3-triazole. The TPSA of 76.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitrophenyl)-2h-1,2,3-triazole. Following Lipinski's Rule of Five, 2-(4-Nitrophenyl)-2h-1,2,3-triazole has 0 hydrogen bond donor(s) and 4 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-(4-Nitrophenyl)-2h-1,2,3-triazole?
The CAS number of 2-(4-Nitrophenyl)-2h-1,2,3-triazole is 18922-72-0.
What is the molecular formula of 2-(4-Nitrophenyl)-2h-1,2,3-triazole?
The molecular formula of 2-(4-Nitrophenyl)-2h-1,2,3-triazole is C8H6N4O2.
What is the molecular weight of 2-(4-Nitrophenyl)-2h-1,2,3-triazole?
The molecular weight of 2-(4-Nitrophenyl)-2h-1,2,3-triazole is 190.05 g/mol.
Where can I buy 2-(4-Nitrophenyl)-2h-1,2,3-triazole?
You can request a quote for 2-(4-Nitrophenyl)-2h-1,2,3-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Nitrophenyl)-2h-1,2,3-triazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitrophenyl)-2h-1,2,3-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.