1-(1,5-Dimethyltriazol-4-yl)ethanone
TL;DR: 1-(1,5-Dimethyltriazol-4-yl)ethanone (CAS 151797-83-0) is a chemical compound with molecular formula C6H9N3O and molecular weight 139.07455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1,5-dimethyltriazol-4-yl)ethanone
Also Known As: 1-(1,5-dimethyltriazol-4-yl)ethanone, 4-acetyl-1,5-dimethyl-1,2,3-triazole, 1-(dimethyl-1H-1,2,3-triazol-4-yl)ethan-1-one, 4-Acetyl-1,5-dimethyl-1H-1,2,3-triazole, 1-(1,5-Dimethyl-1H-1,2,3-triazol-4-yl)ethanone
Technical Specifications
| Molecular Formula | C6H9N3O |
| Molecular Weight | 139.07455 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.07455 Da |
| Heavy Atoms | 10 |
| Complexity | 148.0 |
| SMILES | CC1=C(N=NN1C)C(=O)C |
| InChIKey | MCIHIVHKYDVHKQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(1,5-Dimethyltriazol-4-yl)ethanone
Property Insights of 1-(1,5-Dimethyltriazol-4-yl)ethanone
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,5-Dimethyltriazol-4-yl)ethanone. With a topological polar surface area (TPSA) of 47.8 Ų, 1-(1,5-Dimethyltriazol-4-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,5-Dimethyltriazol-4-yl)ethanone has 0 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-(1,5-Dimethyltriazol-4-yl)ethanone?
The CAS number of 1-(1,5-Dimethyltriazol-4-yl)ethanone is 151797-83-0.
What is the molecular formula of 1-(1,5-Dimethyltriazol-4-yl)ethanone?
The molecular formula of 1-(1,5-Dimethyltriazol-4-yl)ethanone is C6H9N3O.
What is the molecular weight of 1-(1,5-Dimethyltriazol-4-yl)ethanone?
The molecular weight of 1-(1,5-Dimethyltriazol-4-yl)ethanone is 139.07455 g/mol.
Where can I buy 1-(1,5-Dimethyltriazol-4-yl)ethanone?
You can request a quote for 1-(1,5-Dimethyltriazol-4-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(1,5-Dimethyltriazol-4-yl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(1,5-Dimethyltriazol-4-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.