ChemSpider 2D Image | Cyclobutylideneacetonitrile | C6H7N

Cyclobutylideneacetonitrile

  • Molecular FormulaC6H7N
  • Average mass93.127 Da
  • Monoisotopic mass93.057846 Da
  • ChemSpider ID24751218

More details:






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

Acetonitrile, 2-cyclobutylidene- [ACD/Index Name]
Cyclobutylidenacetonitril [German] [ACD/IUPAC Name]
Cyclobutylideneacetonitrile [ACD/IUPAC Name]
Cyclobutylidèneacétonitrile [French] [ACD/IUPAC Name]
27784-69-6 [RN]
2-Cyclobutylideneacetonitrile
2-CYCLOBUTYLIDENEACETONITRILE|2-CYCLOBUTYLIDENEACETONITRILE
2-cyclobutylideneethanenitrile
Chemistry 4895
MFCD12963766 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 182.1±9.0 °C at 760 mmHg
    Vapour Pressure: 0.8±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 41.8±3.0 kJ/mol
    Flash Point: 63.4±11.2 °C
    Index of Refraction: 1.636
    Molar Refractivity: 29.2±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.22
    ACD/LogD (pH 5.5): 1.43
    ACD/BCF (pH 5.5): 7.16
    ACD/KOC (pH 5.5): 142.48
    ACD/LogD (pH 7.4): 1.43
    ACD/BCF (pH 7.4): 7.16
    ACD/KOC (pH 7.4): 142.48
    Polar Surface Area: 24 Å2
    Polarizability: 11.6±0.5 10-24cm3
    Surface Tension: 67.6±3.0 dyne/cm
    Molar Volume: 81.6±3.0 cm3

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