ChemSpider 2D Image | 1-Isocyanato-2-methylcyclopropane | C5H7NO

1-Isocyanato-2-methylcyclopropane

  • Molecular FormulaC5H7NO
  • Average mass97.115 Da
  • Monoisotopic mass97.052765 Da
  • ChemSpider ID24200668

More details:

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

1-Isocyanato-2-methylcyclopropan [German] [ACD/IUPAC Name]
1-Isocyanato-2-methylcyclopropane [ACD/IUPAC Name]
1-Isocyanato-2-méthylcyclopropane [French] [ACD/IUPAC Name]
Cyclopropane, 1-isocyanato-2-methyl- [ACD/Index Name]
1016807-38-7 [RN]
AKOS000195700
AKOS016042368
F2163-0138
MFCD09950508
MolPort-004-352-087
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 102.3±9.0 °C at 760 mmHg
    Vapour Pressure: 33.8±0.2 mmHg at 25°C
    Enthalpy of Vaporization: 34.1±3.0 kJ/mol
    Flash Point: 22.2±21.3 °C
    Index of Refraction: 1.541
    Molar Refractivity: 26.8±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.69
    ACD/LogD (pH 5.5): 1.67
    ACD/BCF (pH 5.5): 10.97
    ACD/KOC (pH 5.5): 193.34
    ACD/LogD (pH 7.4): 1.67
    ACD/BCF (pH 7.4): 10.97
    ACD/KOC (pH 7.4): 193.34
    Polar Surface Area: 29 Å2
    Polarizability: 10.6±0.5 10-24cm3
    Surface Tension: 37.4±7.0 dyne/cm
    Molar Volume: 85.1±7.0 cm3

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