ChemSpider 2D Image | 3,4-Dihydropyrrolo[2,3-d]imidazol-2(1H)-one | C5H5N3O

3,4-Dihydropyrrolo[2,3-d]imidazol-2(1H)-one

  • Molecular FormulaC5H5N3O
  • Average mass123.113 Da
  • Monoisotopic mass123.043259 Da
  • ChemSpider ID26995168

More details:

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

3,4-Dihydropyrrolo[2,3-d]imidazol-2(1H)-on [German] [ACD/IUPAC Name]
3,4-Dihydropyrrolo[2,3-d]imidazol-2(1H)-one [ACD/IUPAC Name]
3,4-Dihydropyrrolo[2,3-d]imidazol-2(1H)-one [French] [ACD/IUPAC Name]
Pyrrolo[2,3-d]imidazol-2(1H)-one, 3,4-dihydro- [ACD/Index Name]
pyrroloimidazolidone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 154.3±9.0 °C at 760 mmHg
Vapour Pressure: 3.2±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.1±3.0 kJ/mol
Flash Point: 47.1±18.7 °C
Index of Refraction: 1.632
Molar Refractivity: 30.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.32
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.82
ACD/KOC (pH 5.5): 53.34
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.82
ACD/KOC (pH 7.4): 53.47
Polar Surface Area: 57 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 85.4±3.0 cm3

Click to predict properties on the Chemicalize site


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