3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine
TL;DR: 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine (CAS 111853-51-1) is a chemical compound with molecular formula C6H12N4O2 and molecular weight 172.09602 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-bis(methoxymethyl)-1,2,4-triazol-4-amine
Also Known As: 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine, 3,5-bis-methoxymethyl-1,2,4-triazol-4-ylamine, 3,5-bis(methoxymethyl)-1,2,4-triazol-4-amine, 4H-1,2,4-Triazol-4-amine,3,5-bis(methoxymethyl)-, 3,5-Bismethoxymethyl-1,2,4-triazol-4-ylamine
Technical Specifications
| Molecular Formula | C6H12N4O2 |
| Molecular Weight | 172.09602 g/mol |
| XLogP | -1.4 |
| Topological Polar Surface Area (TPSA) | 75.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 172.09602 Da |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
| SMILES | COCC1=NN=C(N1N)COC |
| InChIKey | QMTIGFLCQANSAT-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine
Property Insights of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine
The XLogP value of -1.4 indicates that 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine 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 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine is 111853-51-1.
What is the molecular formula of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine is C6H12N4O2.
What is the molecular weight of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine is 172.09602 g/mol.
Where can I buy 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine?
Yes, CoreyChem provides custom synthesis services for 3,5-Bis(methoxymethyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.