ChemSpider 2D Image | Mesityl(phenyl)acetonitrile | C17H17N

Mesityl(phenyl)acetonitrile

  • Molecular FormulaC17H17N
  • Average mass235.324 Da
  • Monoisotopic mass235.136093 Da
  • ChemSpider ID23553504

More details:

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

Benzeneacetonitrile, 2,4,6-trimethyl-α-phenyl- [ACD/Index Name]
Mesityl(phenyl)acetonitril [German] [ACD/IUPAC Name]
Mesityl(phenyl)acetonitrile [ACD/IUPAC Name]
Mésityl(phényl)acétonitrile [French] [ACD/IUPAC Name]
2-Mesityl-2-phenylacetonitrile
2-phenyl-2-(2,4,6-trimethylphenyl)acetonitrile
32189-29-0 [RN]
MFCD19302999 [MDL number]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 366.3±11.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.3±3.0 kJ/mol
    Flash Point: 182.5±5.7 °C
    Index of Refraction: 1.567
    Molar Refractivity: 74.6±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.68
    ACD/LogD (pH 5.5): 4.90
    ACD/BCF (pH 5.5): 3126.85
    ACD/KOC (pH 5.5): 11050.76
    ACD/LogD (pH 7.4): 4.90
    ACD/BCF (pH 7.4): 3126.85
    ACD/KOC (pH 7.4): 11050.76
    Polar Surface Area: 24 Å2
    Polarizability: 29.6±0.5 10-24cm3
    Surface Tension: 41.1±3.0 dyne/cm
    Molar Volume: 228.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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