ChemSpider 2D Image | 1H-Imidazo[1,5-a]imidazol-5(6H)-one | C5H5N3O

1H-Imidazo[1,5-a]imidazol-5(6H)-one

  • Molecular FormulaC5H5N3O
  • Average mass123.113 Da
  • Monoisotopic mass123.043259 Da
  • ChemSpider ID24746939

More details:

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

1,6-Dihydro-5H-imidazo[1,5-a]imidazol-5-on [German] [ACD/IUPAC Name]
1,6-Dihydro-5H-imidazo[1,5-a]imidazol-5-one [ACD/IUPAC Name]
1,6-Dihydro-5H-imidazo[1,5-a]imidazol-5-one [French] [ACD/IUPAC Name]
1H-Imidazo[1,5-a]imidazol-5(6H)-one
518036-07-2 [RN]
5H-Imidazo[1,5-a]imidazol-5-one, 1,6-dihydro- [ACD/Index Name]
[518036-07-2] [RN]
1,6-dihydroimidazo[1,2-c]imidazol-5-one
5H-Imidazo[1,5-a]imidazol-5-one, 1,6-dihydro- (9CI)
MFCD18072813 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.735
    Molar Refractivity: 32.0±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.65
    ACD/LogD (pH 5.5): -1.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.29
    ACD/LogD (pH 7.4): -0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 9.18
    Polar Surface Area: 44 Å2
    Polarizability: 12.7±0.5 10-24cm3
    Surface Tension: 69.8±5.0 dyne/cm
    Molar Volume: 79.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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