ChemSpider 2D Image | 1-(2-Thienyl)cyclopropanecarbonitrile | C8H7NS

1-(2-Thienyl)cyclopropanecarbonitrile

  • Molecular FormulaC8H7NS
  • Average mass149.213 Da
  • Monoisotopic mass149.029922 Da
  • ChemSpider ID13919133

More details:

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

1-(2-Thienyl)cyclopropancarbonitril [German] [ACD/IUPAC Name]
1-(2-Thienyl)cyclopropanecarbonitrile [ACD/IUPAC Name]
1-(2-Thiényl)cyclopropanecarbonitrile [French] [ACD/IUPAC Name]
Cyclopropanecarbonitrile, 1-(2-thienyl)- [ACD/Index Name]
[162959-93-5] [RN]
1-(thiophen-2-yl)cyclopropane-1-carbonitrile
1-(thiophen-2-yl)cyclopropanecarbonitrile
162959-93-5 [RN]
1-Thien-2-ylcyclopropanecarbonitrile
1-thiophen-2-ylcyclopropane-1-carbonitrile
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 288.2±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.7±3.0 kJ/mol
    Flash Point: 128.1±22.6 °C
    Index of Refraction: 1.598
    Molar Refractivity: 41.3±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.21
    ACD/LogD (pH 5.5): 1.93
    ACD/BCF (pH 5.5): 17.19
    ACD/KOC (pH 5.5): 266.64
    ACD/LogD (pH 7.4): 1.93
    ACD/BCF (pH 7.4): 17.19
    ACD/KOC (pH 7.4): 266.64
    Polar Surface Area: 52 Å2
    Polarizability: 16.4±0.5 10-24cm3
    Surface Tension: 51.7±5.0 dyne/cm
    Molar Volume: 121.2±5.0 cm3

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