4H-1,2,4-Triazole, 4-methyl-
TL;DR: 4H-1,2,4-Triazole, 4-methyl- (CAS 10570-40-8) is a chemical compound with molecular formula C3H5N3 and molecular weight 83.04835 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-1,2,4-triazole
Also Known As: 4-Methyl-4H-1,2,4-triazole, 4-Methyl-1,2,4-triazole, 4H-1,2,4-Triazole, 4-methyl-, 1-methyl-1,3,4-triazole, 1,2,4-Triazole, 4-methyl-
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H5N3 |
| Molecular Weight | 83.04835 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 30.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 83.04835 Da |
| Heavy Atoms | 6 |
| Complexity | 39.0 |
| SMILES | CN1C=NN=C1 |
| InChIKey | XILPCSMEKCBYFO-UHFFFAOYSA-N |
Chemical Property Profile of 4H-1,2,4-Triazole, 4-methyl-
Property Insights of 4H-1,2,4-Triazole, 4-methyl-
The XLogP value of -0.6 indicates that 4H-1,2,4-Triazole, 4-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, 4H-1,2,4-Triazole, 4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1,2,4-Triazole, 4-methyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4H-1,2,4-Triazole, 4-methyl-?
The CAS number of 4H-1,2,4-Triazole, 4-methyl- is 10570-40-8.
What is the molecular formula of 4H-1,2,4-Triazole, 4-methyl-?
The molecular formula of 4H-1,2,4-Triazole, 4-methyl- is C3H5N3.
What is the molecular weight of 4H-1,2,4-Triazole, 4-methyl-?
The molecular weight of 4H-1,2,4-Triazole, 4-methyl- is 83.04835 g/mol.
Where can I buy 4H-1,2,4-Triazole, 4-methyl-?
You can request a quote for 4H-1,2,4-Triazole, 4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4H-1,2,4-Triazole, 4-methyl-?
Yes, CoreyChem provides custom synthesis services for 4H-1,2,4-Triazole, 4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.