5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole
TL;DR: 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole (CAS 143681-61-2) is a chemical compound with molecular formula C8H12F3N3 and molecular weight 207.09833 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole
Also Known As: 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole, 3-(Trifluoromethyl)-5-pentyl-1H-1,2,4-triazole, 3-pentyl-5-(trifluoromethyl)-2H-1,2,4-triazole, 3-pentyl-5-(trifluoromethyl)-2H-[1,2,4]triazole
Technical Specifications
| Molecular Formula | C8H12F3N3 |
| Molecular Weight | 207.09833 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.09833 Da |
| Heavy Atoms | 14 |
| Complexity | 172.0 |
| SMILES | CCCCCC1=NC(=NN1)C(F)(F)F |
| InChIKey | ASNWLVYMRWEWRO-UHFFFAOYSA-N |
Chemical Property Profile of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole
Property Insights of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole
The XLogP value of 3.2 indicates that 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole 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
What is the CAS number of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole?
The CAS number of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole is 143681-61-2.
What is the molecular formula of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole?
The molecular formula of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole is C8H12F3N3.
What is the molecular weight of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole?
The molecular weight of 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole is 207.09833 g/mol.
Where can I buy 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole?
You can request a quote for 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole?
Yes, CoreyChem provides custom synthesis services for 5-pentyl-3-(trifluoromethyl)-1H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.