ChemSpider 2D Image | 3-Phenyl-3,4-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one | C10H7N5O

3-Phenyl-3,4-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

  • Molecular FormulaC10H7N5O
  • Average mass213.195 Da
  • Monoisotopic mass213.065063 Da
  • ChemSpider ID21676933

More details:

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

3-Phenyl-3,4-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-on [German] [ACD/IUPAC Name]
3-Phenyl-3,4-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one [ACD/IUPAC Name]
3-Phényl-3,4-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one [French] [ACD/IUPAC Name]
7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 3,6-dihydro-3-phenyl- [ACD/Index Name]
114306-16-0 [RN]
3-phenyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-phenyl-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
3-phenyl-6-hydro-1,2,3-triazolo[5,4-d]pyrimidin-7-one
MFCD03011619 [MDL number]

    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: 1.806
    Molar Refractivity: 58.0±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.43
    ACD/LogD (pH 5.5): 0.84
    ACD/BCF (pH 5.5): 2.55
    ACD/KOC (pH 5.5): 67.98
    ACD/LogD (pH 7.4): 0.69
    ACD/BCF (pH 7.4): 1.80
    ACD/KOC (pH 7.4): 47.83
    Polar Surface Area: 72 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 73.2±7.0 dyne/cm
    Molar Volume: 135.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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