ChemSpider 2D Image | 5-Amino-4-chloro-2-thiophenecarbonitrile | C5H3ClN2S

5-Amino-4-chloro-2-thiophenecarbonitrile

  • Molecular FormulaC5H3ClN2S
  • Average mass158.609 Da
  • Monoisotopic mass157.970551 Da
  • ChemSpider ID45605250

More details:

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

1781791-06-7 [RN]
2-Thiophenecarbonitrile, 5-amino-4-chloro- [ACD/Index Name]
5-Amino-4-chlor-2-thiophencarbonitril [German] [ACD/IUPAC Name]
5-Amino-4-chloro-2-thiophenecarbonitrile [ACD/IUPAC Name]
5-Amino-4-chloro-2-thiophènecarbonitrile [French] [ACD/IUPAC Name]
5-amino-4-chlorothiophene-2-carbonitrile
5-Amino-4-chloro-thiophene-2-carbonitrile

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 293.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.3±3.0 kJ/mol
    Flash Point: 131.4±25.9 °C
    Index of Refraction: 1.645
    Molar Refractivity: 37.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.49
    ACD/LogD (pH 5.5): 1.67
    ACD/BCF (pH 5.5): 10.88
    ACD/KOC (pH 5.5): 192.19
    ACD/LogD (pH 7.4): 1.67
    ACD/BCF (pH 7.4): 10.88
    ACD/KOC (pH 7.4): 192.19
    Polar Surface Area: 78 Å2
    Polarizability: 15.0±0.5 10-24cm3
    Surface Tension: 70.4±5.0 dyne/cm
    Molar Volume: 104.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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