3-Methyl-4,4'-bi(1,2,4-triazole)
TL;DR: 3-Methyl-4,4'-bi(1,2,4-triazole) (CAS 63523-91-1) is a chemical compound with molecular formula C5H6N6 and molecular weight 150.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-(1,2,4-triazol-4-yl)-1,2,4-triazole
Also Known As: 3-Methyl-4,4'-bi(1,2,4-triazole), 3-Methyl-4,4'-bi-1,2,4-triazole, 4,4'-Bi-4H-1,2,4-triazole, 3-methyl-, 3-Methyl-4,4'-bis-(1,2,4-triazol), 3-methyl-4-(1,2,4-triazol-4-yl)-1,2,4-triazole
| Molecular Formula | C5H6N6 |
|---|---|
| Molecular Weight | 150.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 150.0654 |
| Heavy Atoms | 11 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 63523-91-1 |
|---|---|
| SMILES | CC1=NN=CN1N2C=NN=C2 |
| InChIKey | DAMHRAUQYOUUKT-UHFFFAOYSA-N |
Product Overview
3-Methyl-4,4'-bi(1,2,4-triazole) (CAS 63523-91-1), with molecular formula C5H6N6 and molecular weight 150.07 g/mol. IUPAC: 3-methyl-4-(1,2,4-triazol-4-yl)-1,2,4-triazole.
Chemical Property Profile of 3-Methyl-4,4'-bi(1,2,4-triazole)
Property Insights of 3-Methyl-4,4'-bi(1,2,4-triazole)
The XLogP value of -0.6 indicates that 3-Methyl-4,4'-bi(1,2,4-triazole) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-4,4'-bi(1,2,4-triazole). Following Lipinski's Rule of Five, 3-Methyl-4,4'-bi(1,2,4-triazole) has 0 hydrogen bond donor(s) and 4 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-Methyl-4,4'-bi(1,2,4-triazole)?
The CAS number of 3-Methyl-4,4'-bi(1,2,4-triazole) is 63523-91-1.
What is the molecular formula of 3-Methyl-4,4'-bi(1,2,4-triazole)?
The molecular formula of 3-Methyl-4,4'-bi(1,2,4-triazole) is C5H6N6.
What is the molecular weight of 3-Methyl-4,4'-bi(1,2,4-triazole)?
The molecular weight of 3-Methyl-4,4'-bi(1,2,4-triazole) is 150.07 g/mol.
Where can I buy 3-Methyl-4,4'-bi(1,2,4-triazole)?
You can request a quote for 3-Methyl-4,4'-bi(1,2,4-triazole) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-4,4'-bi(1,2,4-triazole)?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-4,4'-bi(1,2,4-triazole) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.