5-(Chloromethyl)-1-methyl-1H-1,2,4-triazole

Base Information

• Chemical Name: 5-(Chloromethyl)-1-methyl-1H-1,2,4-triazole
• CAS No.: 153851-72-0
• Molecular Formula: C4H6 Cl N3
• Molecular Weight: 131.56
• DSSTox Substance ID: DTXSID20439510
• Nikkaji Number: J567.036E
• Mol file: 153851-72-0.mol

Synonyms:153851-72-0;5-CHLOROMETHYL-1-METHYL-1H-[1,2,4]TRIAZOLE;5-(CHLOROMETHYL)-1-METHYL-1H-1,2,4-TRIAZOLE;5-(chloromethyl)-1-methyl-1,2,4-triazole;SCHEMBL2650047;DTXSID20439510;TQP0650;FRSUDGCEBGTNAB-UHFFFAOYSA-N;AKOS006330860;2-methyl-3-chloromethyl-1,2,4-triazole;BB 0257759;FT-0726532;5-Chloromethyl-1-methyl-1H-1,2,4-triazole;F31187;3-(chloromethyl)-2-methyl-2H-[1,2,4]triazole

Chemical Property of 5-(Chloromethyl)-1-methyl-1H-1,2,4-triazole

Chemical Property:

• Boiling Point: 255.3±42.0 °C(Predicted)
• PKA: 2.44±0.10(Predicted)
• PSA: 30.71000
• Density: 1.36±0.1 g/cm3(Predicted)
• LogP: 0.55390
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 131.0250249
• Heavy Atom Count: 8
• Complexity: 77.7

Purity/Quality:

98% ^*data from raw suppliers

5-(Chloromethyl)-1-methyl-1H-1,2,4-triazole 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=NC=N1)CCl