4-(2-Nitroethenyl)-2-phenyltriazole
TL;DR: 4-(2-Nitroethenyl)-2-phenyltriazole (CAS 3156-68-1) is a chemical compound with molecular formula C10H8N4O2 and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-nitroethenyl)-2-phenyltriazole
Also Known As: 4-(2-nitroethenyl)-2-phenyltriazole, 4-{2-nitrovinyl}-2-phenyl-2H-1,2,3-triazole
| Molecular Formula | C10H8N4O2 |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | 1.5147 |
| Topological Polar Surface Area | 73.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.06473 |
| Heavy Atoms | 16 |
| Complexity | 518.6251 |
Chemical Identifiers
| CAS Number | 3156-68-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=CC(=N2)C=C[N+](=O)[O-] |
Product Overview
4-(2-Nitroethenyl)-2-phenyltriazole (CAS 3156-68-1), with molecular formula C10H8N4O2 and molecular weight 216.06 g/mol. IUPAC: 4-(2-nitroethenyl)-2-phenyltriazole.
Chemical Property Profile of 4-(2-Nitroethenyl)-2-phenyltriazole
Property Insights of 4-(2-Nitroethenyl)-2-phenyltriazole
The XLogP value of 1.5147 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Nitroethenyl)-2-phenyltriazole. The TPSA of 73.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Nitroethenyl)-2-phenyltriazole. Following Lipinski's Rule of Five, 4-(2-Nitroethenyl)-2-phenyltriazole 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 4-(2-Nitroethenyl)-2-phenyltriazole?
The CAS number of 4-(2-Nitroethenyl)-2-phenyltriazole is 3156-68-1.
What is the molecular formula of 4-(2-Nitroethenyl)-2-phenyltriazole?
The molecular formula of 4-(2-Nitroethenyl)-2-phenyltriazole is C10H8N4O2.
What is the molecular weight of 4-(2-Nitroethenyl)-2-phenyltriazole?
The molecular weight of 4-(2-Nitroethenyl)-2-phenyltriazole is 216.06 g/mol.
Where can I buy 4-(2-Nitroethenyl)-2-phenyltriazole?
You can request a quote for 4-(2-Nitroethenyl)-2-phenyltriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Nitroethenyl)-2-phenyltriazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Nitroethenyl)-2-phenyltriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.