ChemSpider 2D Image | 4-Fluoro-1-methyl-1H-1,2,3-triazole-5-carbaldehyde | C4H4FN3O

4-Fluoro-1-methyl-1H-1,2,3-triazole-5-carbaldehyde

  • Molecular FormulaC4H4FN3O
  • Average mass129.092 Da
  • Monoisotopic mass129.033844 Da
  • ChemSpider ID96944551

More details:

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

1H-1,2,3-Triazole-5-carboxaldehyde, 4-fluoro-1-methyl- [ACD/Index Name]
4-Fluor-1-methyl-1H-1,2,3-triazol-5-carbaldehyd [German] [ACD/IUPAC Name]
4-Fluoro-1-methyl-1H-1,2,3-triazole-5-carbaldehyde [ACD/IUPAC Name]
4-Fluoro-1-méthyl-1H-1,2,3-triazole-5-carbaldéhyde [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 254.9±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 107.9±28.2 °C
Index of Refraction: 1.576
Molar Refractivity: 29.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.82
ACD/LogD (pH 5.5): -0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.78
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.78
Polar Surface Area: 48 Å2
Polarizability: 11.5±0.5 10-24cm3
Surface Tension: 44.1±7.0 dyne/cm
Molar Volume: 87.7±7.0 cm3

Click to predict properties on the Chemicalize site


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