ChemSpider 2D Image | 4-(Hydroxymethyl)-1,2,4-triazolidine-3,5-dione | C3H5N3O3

4-(Hydroxymethyl)-1,2,4-triazolidine-3,5-dione

  • Molecular FormulaC3H5N3O3
  • Average mass131.090 Da
  • Monoisotopic mass131.033096 Da
  • ChemSpider ID29776952

More details:

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

1,2,4-Triazolidine-3,5-dione, 4-(hydroxymethyl)- [ACD/Index Name]
4-(Hydroxymethyl)-1,2,4-triazolidin-3,5-dion [German] [ACD/IUPAC Name]
4-(Hydroxymethyl)-1,2,4-triazolidine-3,5-dione [ACD/IUPAC Name]
4-(Hydroxyméthyl)-1,2,4-triazolidine-3,5-dione [French] [ACD/IUPAC Name]
1,2,4-Triazolidine-3,5-dione, 4-(hydroxymethyl)- (9CI)
4-(Hydroxymethyl)-4H-1,2,4-triazole-3,5-diol
474459-27-3 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.535
Molar Refractivity: 26.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -2.71
ACD/LogD (pH 5.5): -2.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 82 Å2
Polarizability: 10.3±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 83.4±3.0 cm3

Click to predict properties on the Chemicalize site


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