ChemSpider 2D Image | 4,5-Dihydro-3H-1,2,4-triazol-3-one | C2H3N3O

4,5-Dihydro-3H-1,2,4-triazol-3-one

  • Molecular FormulaC2H3N3O
  • Average mass85.065 Da
  • Monoisotopic mass85.027611 Da
  • ChemSpider ID15873980

More details:






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

3H-1,2,4-Triazol-3-one, 4,5-dihydro- [ACD/Index Name]
4,5-Dihydro-3H-1,2,4-triazol-3-on [German] [ACD/IUPAC Name]
4,5-Dihydro-3H-1,2,4-triazol-3-one [ACD/IUPAC Name]
4,5-Dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]
1,2,4-Triazolin-3-one

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.754
Molar Refractivity: 19.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.00
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.33
ACD/LogD (pH 7.4): -0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.32
Polar Surface Area: 54 Å2
Polarizability: 7.6±0.5 10-24cm3
Surface Tension: 82.7±7.0 dyne/cm
Molar Volume: 47.0±7.0 cm3

Click to predict properties on the Chemicalize site






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