ChemSpider 2D Image | 2-[4-(1,3-Benzodioxol-5-yl)-3-(methoxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-hydroxypropyl)acetamide | C16H20N4O6

2-[4-(1,3-Benzodioxol-5-yl)-3-(methoxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-hydroxypropyl)acetamide

  • Molecular FormulaC16H20N4O6
  • Average mass364.353 Da
  • Monoisotopic mass364.138275 Da
  • ChemSpider ID29688078

More details:

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

1H-1,2,4-Triazole-1-acetamide, 4-(1,3-benzodioxol-5-yl)-4,5-dihydro-N-(2-hydroxypropyl)-3-(methoxymethyl)-5-oxo- [ACD/Index Name]
2-[4-(1,3-Benzodioxol-5-yl)-3-(methoxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-hydroxypropyl)acetamid [German] [ACD/IUPAC Name]
2-[4-(1,3-Benzodioxol-5-yl)-3-(methoxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-hydroxypropyl)acetamide [ACD/IUPAC Name]
2-[4-(1,3-Benzodioxol-5-yl)-3-(méthoxyméthyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-hydroxypropyl)acétamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.646
Molar Refractivity: 89.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -1.91
ACD/LogD (pH 5.5): -1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.22
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.22
Polar Surface Area: 113 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 57.4±7.0 dyne/cm
Molar Volume: 245.2±7.0 cm3

Click to predict properties on the Chemicalize site


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