3-Hexyl-1h-1,2,4-triazol-5-amine
TL;DR: 3-Hexyl-1h-1,2,4-triazol-5-amine (CAS 77077-42-0) is a chemical compound with molecular formula C8H16N4 and molecular weight 168.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hexyl-1H-1,2,4-triazol-3-amine
Also Known As: 3-Hexyl-1h-1,2,4-triazol-5-amine, 5-hexyl-1H-1,2,4-triazol-3-amine, 3-amino-5-hexyl-1h-1,2,4-triazole, 1H-1,2,4-Triazol-3-amine, 5-hexyl-
| Molecular Formula | C8H16N4 |
|---|---|
| Molecular Weight | 168.14 g/mol |
| LogP | 1.5097 |
| Topological Polar Surface Area | 67.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.1375 |
| Heavy Atoms | 12 |
| Complexity | 218.58737 |
Chemical Identifiers
| CAS Number | 77077-42-0 |
|---|---|
| SMILES | CCCCCCC1=NC(=NN1)N |
Product Overview
3-Hexyl-1h-1,2,4-triazol-5-amine (CAS 77077-42-0), with molecular formula C8H16N4 and molecular weight 168.14 g/mol. IUPAC: 5-hexyl-1H-1,2,4-triazol-3-amine.
Chemical Property Profile of 3-Hexyl-1h-1,2,4-triazol-5-amine
Property Insights of 3-Hexyl-1h-1,2,4-triazol-5-amine
The XLogP value of 1.5097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hexyl-1h-1,2,4-triazol-5-amine. The TPSA of 67.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hexyl-1h-1,2,4-triazol-5-amine. Following Lipinski's Rule of Five, 3-Hexyl-1h-1,2,4-triazol-5-amine has 2 hydrogen bond donor(s) and 3 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 3-Hexyl-1h-1,2,4-triazol-5-amine?
The CAS number of 3-Hexyl-1h-1,2,4-triazol-5-amine is 77077-42-0.
What is the molecular formula of 3-Hexyl-1h-1,2,4-triazol-5-amine?
The molecular formula of 3-Hexyl-1h-1,2,4-triazol-5-amine is C8H16N4.
What is the molecular weight of 3-Hexyl-1h-1,2,4-triazol-5-amine?
The molecular weight of 3-Hexyl-1h-1,2,4-triazol-5-amine is 168.14 g/mol.
Where can I buy 3-Hexyl-1h-1,2,4-triazol-5-amine?
You can request a quote for 3-Hexyl-1h-1,2,4-triazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hexyl-1h-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-Hexyl-1h-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.