ChemSpider 2D Image | Spiro[2.2]pentane-1-carbonitrile | C6H7N

Spiro[2.2]pentane-1-carbonitrile

  • Molecular FormulaC6H7N
  • Average mass93.127 Da
  • Monoisotopic mass93.057846 Da
  • ChemSpider ID45531569

More details:

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

Spiro[2.2]pentan-1-carbonitril [German] [ACD/IUPAC Name]
Spiro[2.2]pentane-1-carbonitrile [ACD/Index Name] [ACD/IUPAC Name]
Spiro[2.2]pentane-1-carbonitrile [French] [ACD/Index Name] [ACD/IUPAC Name]
345892-44-6 [RN]
atoms 7 bonds 8
MFCD28653875

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.1±0.1 g/cm3
    Boiling Point: 197.3±9.0 °C at 760 mmHg
    Vapour Pressure: 0.4±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 43.3±3.0 kJ/mol
    Flash Point: 67.4±6.5 °C
    Index of Refraction: 1.517
    Molar Refractivity: 25.7±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.30
    ACD/LogD (pH 5.5): 0.47
    ACD/BCF (pH 5.5): 1.35
    ACD/KOC (pH 5.5): 43.10
    ACD/LogD (pH 7.4): 0.47
    ACD/BCF (pH 7.4): 1.35
    ACD/KOC (pH 7.4): 43.10
    Polar Surface Area: 24 Å2
    Polarizability: 10.2±0.5 10-24cm3
    Surface Tension: 41.0±5.0 dyne/cm
    Molar Volume: 84.9±5.0 cm3

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