ChemSpider 2D Image | 5-(2-Hydroxyethyl)-2-thiophenecarbonitrile | C7H7NOS

5-(2-Hydroxyethyl)-2-thiophenecarbonitrile

  • Molecular FormulaC7H7NOS
  • Average mass153.202 Da
  • Monoisotopic mass153.024841 Da
  • ChemSpider ID26528464

More details:

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

2-Thiophenecarbonitrile, 5-(2-hydroxyethyl)- [ACD/Index Name]
5-(2-Hydroxyethyl)-2-thiophencarbonitril [German] [ACD/IUPAC Name]
5-(2-Hydroxyethyl)-2-thiophenecarbonitrile [ACD/IUPAC Name]
5-(2-Hydroxyéthyl)-2-thiophènecarbonitrile [French] [ACD/IUPAC Name]
1333222-43-7 [RN]
5-(2-hydroxyethyl)thiophene-2-carbonitrile
MFCD18207252 [MDL number]

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

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 294.7±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.4±3.0 kJ/mol
    Flash Point: 132.0±23.2 °C
    Index of Refraction: 1.584
    Molar Refractivity: 40.3±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.41
    ACD/LogD (pH 5.5): 1.05
    ACD/BCF (pH 5.5): 3.72
    ACD/KOC (pH 5.5): 89.21
    ACD/LogD (pH 7.4): 1.05
    ACD/BCF (pH 7.4): 3.72
    ACD/KOC (pH 7.4): 89.21
    Polar Surface Area: 72 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 59.0±5.0 dyne/cm
    Molar Volume: 120.3±5.0 cm3

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