1H-1,2,4-Triazole-1-ethanamine
TL;DR: 1H-1,2,4-Triazole-1-ethanamine (CAS 51445-60-4) is a chemical compound with molecular formula C4H8N4 and molecular weight 112.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,2,4-triazol-1-yl)ethanamine
Also Known As: 2-(1H-1,2,4-Triazol-1-yl)ethanamine, 1H-1,2,4-Triazole-1-ethanamine, 2-[1,2,4]Triazol-1-yl-ethylamine, 2-(1,2,4-triazol-1-yl)ethanamine, 2-(1H-1,2,4-TRIAZOL-1-YL)ETHAN-1-AMINE
| Molecular Formula | C4H8N4 |
|---|---|
| Molecular Weight | 112.07 g/mol |
| LogP | -0.7632 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 112.0749 |
| Heavy Atoms | 8 |
| Complexity | 133.75836 |
Chemical Identifiers
| CAS Number | 51445-60-4 |
|---|---|
| SMILES | C1=NN(C=N1)CCN |
Product Overview
1H-1,2,4-Triazole-1-ethanamine (CAS 51445-60-4), with molecular formula C4H8N4 and molecular weight 112.07 g/mol. IUPAC: 2-(1,2,4-triazol-1-yl)ethanamine.
Chemical Property Profile of 1H-1,2,4-Triazole-1-ethanamine
Property Insights of 1H-1,2,4-Triazole-1-ethanamine
The XLogP value of -0.7632 indicates that 1H-1,2,4-Triazole-1-ethanamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.73 Ų, 1H-1,2,4-Triazole-1-ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole-1-ethanamine has 1 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 1H-1,2,4-Triazole-1-ethanamine?
The CAS number of 1H-1,2,4-Triazole-1-ethanamine is 51445-60-4.
What is the molecular formula of 1H-1,2,4-Triazole-1-ethanamine?
The molecular formula of 1H-1,2,4-Triazole-1-ethanamine is C4H8N4.
What is the molecular weight of 1H-1,2,4-Triazole-1-ethanamine?
The molecular weight of 1H-1,2,4-Triazole-1-ethanamine is 112.07 g/mol.
Where can I buy 1H-1,2,4-Triazole-1-ethanamine?
You can request a quote for 1H-1,2,4-Triazole-1-ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole-1-ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole-1-ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.