ChemSpider 2D Image | Thieno[2,3-b]pyridine-2-carbonitrile | C8H4N2S

Thieno[2,3-b]pyridine-2-carbonitrile

  • Molecular FormulaC8H4N2S
  • Average mass160.196 Da
  • Monoisotopic mass160.009521 Da
  • ChemSpider ID32056982

More details:

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

Thieno[2,3-b]pyridin-2-carbonitril [German] [ACD/IUPAC Name]
Thieno[2,3-b]pyridine-2-carbonitrile [ACD/Index Name] [ACD/IUPAC Name]
Thiéno[2,3-b]pyridine-2-carbonitrile [French] [ACD/IUPAC Name]
1824274-54-5 [RN]
MFCD28103332

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 330.5±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.3±3.0 kJ/mol
    Flash Point: 153.7±22.3 °C
    Index of Refraction: 1.690
    Molar Refractivity: 44.8±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.81
    ACD/LogD (pH 5.5): 2.10
    ACD/BCF (pH 5.5): 23.40
    ACD/KOC (pH 5.5): 332.25
    ACD/LogD (pH 7.4): 2.11
    ACD/BCF (pH 7.4): 23.43
    ACD/KOC (pH 7.4): 332.74
    Polar Surface Area: 65 Å2
    Polarizability: 17.8±0.5 10-24cm3
    Surface Tension: 69.3±5.0 dyne/cm
    Molar Volume: 117.3±5.0 cm3

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