ChemSpider 2D Image | 6-(Aminomethyl)-1-isoindolinone | C9H10N2O

6-(Aminomethyl)-1-isoindolinone

  • Molecular FormulaC9H10N2O
  • Average mass162.189 Da
  • Monoisotopic mass162.079315 Da
  • ChemSpider ID28537146

More details:

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

1251195-14-8 [RN]
1H-Isoindol-1-one, 6-(aminomethyl)-2,3-dihydro- [ACD/Index Name]
6-(Aminomethyl)-1-isoindolinon [German] [ACD/IUPAC Name]
6-(Aminomethyl)-1-isoindolinone [ACD/IUPAC Name]
6-(Aminométhyl)-1-isoindolinone [French] [ACD/IUPAC Name]
6-(Aminomethyl)isoindolin-1-one
[1251195-14-8] [RN]
6-(Aminomethyl)-2,3-dihydro-1H-isoindol-1-one
6-(aminomethyl)-2,3-dihydroisoindol-1-one
MFCD22199283 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 467.8±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.0±3.0 kJ/mol
    Flash Point: 236.7±28.4 °C
    Index of Refraction: 1.615
    Molar Refractivity: 45.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.84
    ACD/LogD (pH 5.5): -3.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.82
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 55 Å2
    Polarizability: 18.1±0.5 10-24cm3
    Surface Tension: 53.2±3.0 dyne/cm
    Molar Volume: 131.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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