3-甲基-1H-1,2,4-三唑-5-乙胺
TL;DR: 3-甲基-1H-1,2,4-三唑-5-乙胺 (CAS 61012-32-6) is a chemical compound with molecular formula C5H10N4 and molecular weight 126.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基-1H-1,2,4-三唑-5-乙胺
2-(5-methyl-1H-1,2,4-triazol-3-yl)ethanamine
Also Known As: Iem 813, 2-(5-Methyl-4H-1,2,4-triazol-3-yl)ethanamine, 2-(5-methyl-1H-1,2,4-triazol-3-yl)ethanamine, 2-(5-methyl-1H-1,2,4-triazol-3-yl)ethan-1-amine, 3-(beta-Aminoethyl)-5-methyl-1,2,4-triazole
| Molecular Formula | C5H10N4 |
|---|---|
| Molecular Weight | 126.09 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 67.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.090546 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 61012-32-6 |
|---|---|
| SMILES | CC1=NC(=NN1)CCN |
| InChIKey | FZSOHMVWLBLDDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲基-1H-1,2,4-三唑-5-乙胺 (CAS 61012-32-6), with molecular formula C5H10N4 and molecular weight 126.09 g/mol. IUPAC: 2-(5-methyl-1H-1,2,4-triazol-3-yl)ethanamine.
Chemical Property Profile of 3-甲基-1H-1,2,4-三唑-5-乙胺
Property Insights of 3-甲基-1H-1,2,4-三唑-5-乙胺
The XLogP value of -0.3 indicates that 3-甲基-1H-1,2,4-三唑-5-乙胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-甲基-1H-1,2,4-三唑-5-乙胺. Following Lipinski's Rule of Five, 3-甲基-1H-1,2,4-三唑-5-乙胺 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-甲基-1H-1,2,4-三唑-5-乙胺?
The CAS number of 3-甲基-1H-1,2,4-三唑-5-乙胺 is 61012-32-6.
What is the molecular formula of 3-甲基-1H-1,2,4-三唑-5-乙胺?
The molecular formula of 3-甲基-1H-1,2,4-三唑-5-乙胺 is C5H10N4.
What is the molecular weight of 3-甲基-1H-1,2,4-三唑-5-乙胺?
The molecular weight of 3-甲基-1H-1,2,4-三唑-5-乙胺 is 126.09 g/mol.
Where can I buy 3-甲基-1H-1,2,4-三唑-5-乙胺?
You can request a quote for 3-甲基-1H-1,2,4-三唑-5-乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-1H-1,2,4-三唑-5-乙胺?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-1H-1,2,4-三唑-5-乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.