ChemSpider 2D Image | 4H-1,2,4-Triazol-4-ol | C2H3N3O

4H-1,2,4-Triazol-4-ol

  • Molecular FormulaC2H3N3O
  • Average mass85.065 Da
  • Monoisotopic mass85.027611 Da
  • ChemSpider ID24218187

More details:






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

4H-1,2,4-Triazol-4-ol [ACD/IUPAC Name]
4H-1,2,4-Triazol-4-ol [German] [ACD/IUPAC Name]
4H-1,2,4-Triazol-4-ol [French] [ACD/IUPAC Name]
4H-1,2,4-Triazole, 4-hydroxy- [ACD/Index Name]
"1,2,4-TRIAZOL-4-OL"
"4H-1,2,4-TRIAZOL-4-OL"
38345-13-0 [RN]
4H-1,2,4-Triazole, 4-hydroxy- (9CI)
4H-1,2,4-Triazole,4-hydroxy-
MFCD18819882

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

Density: 1.6±0.1 g/cm3
Boiling Point: 315.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.9±3.0 kJ/mol
Flash Point: 144.8±23.2 °C
Index of Refraction: 1.683
Molar Refractivity: 20.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.99
ACD/LogD (pH 5.5): -0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.73
ACD/LogD (pH 7.4): -0.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.73
Polar Surface Area: 51 Å2
Polarizability: 8.0±0.5 10-24cm3
Surface Tension: 74.7±7.0 dyne/cm
Molar Volume: 53.1±7.0 cm3

Click to predict properties on the Chemicalize site






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