ChemSpider 2D Image | 3-(Diethoxymethyl)-1H-1,2,4-triazole | C7H13N3O2

3-(Diethoxymethyl)-1H-1,2,4-triazole

  • Molecular FormulaC7H13N3O2
  • Average mass171.197 Da
  • Monoisotopic mass171.100784 Da
  • ChemSpider ID16195181

More details:

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

1H-1,2,4-Triazole, 3-(diethoxymethyl)- [ACD/Index Name]
3-(Diethoxymethyl)-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-(Diethoxymethyl)-1H-1,2,4-triazole [ACD/IUPAC Name]
3-(Diéthoxyméthyl)-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
3-(diethoxymethyl)-4H-1,2,4-triazole
33824-15-6 [RN]
MFCD22369859

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

Density: 1.1±0.1 g/cm3
Boiling Point: 281.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.0±3.0 kJ/mol
Flash Point: 103.3±20.4 °C
Index of Refraction: 1.496
Molar Refractivity: 43.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 2.04
ACD/KOC (pH 5.5): 57.92
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 2.04
ACD/KOC (pH 7.4): 57.94
Polar Surface Area: 60 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 150.0±3.0 cm3

Click to predict properties on the Chemicalize site


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