ChemSpider 2D Image | 2-(1H-Triaziren-1-yl)-1,1-ethenediol | C2H3N3O2

2-(1H-Triaziren-1-yl)-1,1-ethenediol

  • Molecular FormulaC2H3N3O2
  • Average mass101.064 Da
  • Monoisotopic mass101.022530 Da
  • ChemSpider ID95749734

More details:

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

1,1-Ethenediol, 2-(1H-triazirin-1-yl)- [ACD/Index Name]
2-(1H-Triaziren-1-yl)-1,1-ethendiol [German] [ACD/IUPAC Name]
2-(1H-Triaziren-1-yl)-1,1-ethenediol [ACD/IUPAC Name]
2-(1H-Triazirén-1-yl)-1,1-éthènediol [French] [ACD/IUPAC Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 169.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.7 mmHg at 25°C
Enthalpy of Vaporization: 47.2±6.0 kJ/mol
Flash Point: 56.1±30.1 °C
Index of Refraction: 1.769
Molar Refractivity: 21.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.94
ACD/LogD (pH 5.5): -1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.40
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.12
Polar Surface Area: 68 Å2
Polarizability: 8.3±0.5 10-24cm3
Surface Tension: 105.0±7.0 dyne/cm
Molar Volume: 50.5±7.0 cm3

Click to predict properties on the Chemicalize site


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