1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine
TL;DR: 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine (CAS 1212100-49-6) is a chemical compound with molecular formula C10H12N4 and molecular weight 188.1062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(1,2,4-triazol-1-yl)phenyl]ethanamine
Also Known As: 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine, 1-[4-(1H-1,2,4-triazol-1-yl)phenyl]ethanamine, 1-[4-(1,2,4-triazol-1-yl)phenyl]ethanamine, ZERO/006140, 1-[4-(1H-1,2,4-triazol-1-yl)phenyl]ethan-1-amine
Technical Specifications
| Molecular Formula | C10H12N4 |
| Molecular Weight | 188.1062 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.1062 Da |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
| SMILES | CC(C1=CC=C(C=C1)N2C=NC=N2)N |
| InChIKey | LWCNLFHKRQJWOW-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine
Property Insights of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine. With a topological polar surface area (TPSA) of 56.7 Ų, 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)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
What is the CAS number of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine?
The CAS number of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine is 1212100-49-6.
What is the molecular formula of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine?
The molecular formula of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine is C10H12N4.
What is the molecular weight of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine?
The molecular weight of 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine is 188.1062 g/mol.
Where can I buy 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine?
You can request a quote for 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine?
Yes, CoreyChem provides custom synthesis services for 1-(4-(1H-1,2,4-Triazol-1-yl)phenyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.