ChemSpider 2D Image | 5-Amino-2,3-dimethyl-2,3-dihydro-1,4-phthalazinedione | C10H11N3O2

5-Amino-2,3-dimethyl-2,3-dihydro-1,4-phthalazinedione

  • Molecular FormulaC10H11N3O2
  • Average mass205.213 Da
  • Monoisotopic mass205.085129 Da
  • ChemSpider ID21665073

More details:

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

1,4-Phthalazinedione, 5-amino-2,3-dihydro-2,3-dimethyl- [ACD/Index Name]
5-Amino-2,3-diméthyl-2,3-dihydro-1,4-phtalazinedione [French] [ACD/IUPAC Name]
5-Amino-2,3-dimethyl-2,3-dihydro-1,4-phthalazindion [German] [ACD/IUPAC Name]
5-Amino-2,3-dimethyl-2,3-dihydro-1,4-phthalazinedione [ACD/IUPAC Name]
5-Amino-2,3-dimethyl-2,3-dihydrophthalazine-1,4-dione
873967-42-1 [RN]
[873967-42-1] [RN]
5-amino-2,3-dimethyl-1,2,3,4-tetrahydrophthalazine-1,4-dione
5-amino-2,3-dimethylphthalazine-1,4-dione
MFCD09064011 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 390.7±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.0±3.0 kJ/mol
    Flash Point: 190.1±28.4 °C
    Index of Refraction: 1.633
    Molar Refractivity: 54.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.18
    ACD/LogD (pH 5.5): -0.48
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 13.05
    ACD/LogD (pH 7.4): -0.48
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 13.05
    Polar Surface Area: 67 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 57.7±3.0 dyne/cm
    Molar Volume: 153.6±3.0 cm3

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