ChemSpider 2D Image | 1-[2-(Difluoromethoxy)ethyl]-1H-1,2,4-triazol-3-amine | C5H8F2N4O

1-[2-(Difluoromethoxy)ethyl]-1H-1,2,4-triazol-3-amine

  • Molecular FormulaC5H8F2N4O
  • Average mass178.140 Da
  • Monoisotopic mass178.066620 Da
  • ChemSpider ID113128904

More details:

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

1-[2-(Difluormethoxy)ethyl]-1H-1,2,4-triazol-3-amin [German] [ACD/IUPAC Name]
1-[2-(Difluoromethoxy)ethyl]-1H-1,2,4-triazol-3-amine [ACD/IUPAC Name]
1-[2-(Difluorométhoxy)éthyl]-1H-1,2,4-triazol-3-amine [French] [ACD/IUPAC Name]
1H-1,2,4-Triazol-3-amine, 1-[2-(difluoromethoxy)ethyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 310.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 141.7±30.7 °C
Index of Refraction: 1.548
Molar Refractivity: 36.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.66
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.68
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.85
Polar Surface Area: 66 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 43.9±7.0 dyne/cm
Molar Volume: 113.8±7.0 cm3

Click to predict properties on the Chemicalize site


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