Ethanone, 1-(1-methyl-1H-1,2,3-triazol-4-yl)-

Base Information

• Chemical Name: Ethanone, 1-(1-methyl-1H-1,2,3-triazol-4-yl)-
• CAS No.: 128979-26-0
• Molecular Formula: C5H7N3O
• Molecular Weight: 125.12900
• European Community (EC) Number: 882-629-8
• DSSTox Substance ID: DTXSID60443919
• Nikkaji Number: J857.722F
• Wikidata: Q82261908
• Mol file: 128979-26-0.mol

Synonyms:128979-26-0;1-(1-methyltriazol-4-yl)ethanone;Ethanone, 1-(1-methyl-1H-1,2,3-triazol-4-yl)-;1-(1-methyl-1h-1,2,3-triazol-4-yl)ethanone;Ethanone, 1-(1-methyl-1H-1,2,3-triazol-4-yl)- (9CI);SCHEMBL3404701;DTXSID60443919;AKOS022902706;EN300-244546;1-(1-methyl-1H-1,2,3-triazol-4-yl)ethan-1-one;Z1216849088

Chemical Property of Ethanone, 1-(1-methyl-1H-1,2,3-triazol-4-yl)-

Chemical Property:

• PSA: 47.78000
• LogP: 0.01770
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 125.058911855
• Heavy Atom Count: 9
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

1-(1-methyl-1H-1,2,3-triazol-4-yl)ethan-1-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CN(N=N1)C