ChemSpider 2D Image | 1-Methyl-1H-1,2,3-triazole-4-carbonyl chloride | C4H4ClN3O

1-Methyl-1H-1,2,3-triazole-4-carbonyl chloride

  • Molecular FormulaC4H4ClN3O
  • Average mass145.547 Da
  • Monoisotopic mass145.004288 Da
  • ChemSpider ID24186961

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-1,2,3-Triazole-4-carbonyl chloride, 1-methyl- [ACD/Index Name]
1-Methyl-1H-1,2,3-triazol-4-carbonylchlorid [German] [ACD/IUPAC Name]
1-Methyl-1H-1,2,3-triazole-4-carbonyl chloride [ACD/IUPAC Name]
54470-12-1 [RN]
Chlorure de 1-méthyl-1H-1,2,3-triazole-4-carbonyle [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carbonyl chloride, 1-methyl- (9CI)
1H-1,2,3-TRIAZOLE-4-CARBONYL CHLORIDE,1-METHYL-
MFCD13173546

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 255.1±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.3±3.0 kJ/mol
Flash Point: 108.1±25.1 °C
Index of Refraction: 1.636
Molar Refractivity: 33.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.40
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.43
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.43
Polar Surface Area: 48 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 94.1±7.0 cm3

Click to predict properties on the Chemicalize site


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