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ChemSpider 2D Image | N-[2-(2-Thienyl)ethyl]nicotinamide | C12H12N2OS

N-[2-(2-Thienyl)ethyl]nicotinamide

  • Molecular FormulaC12H12N2OS
  • Average mass232.301 Da
  • Monoisotopic mass232.067032 Da
  • ChemSpider ID22445775

More details:

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

3-Pyridinecarboxamide, N-[2-(2-thienyl)ethyl]- [ACD/Index Name]
N-[2-(2-Thienyl)ethyl]nicotinamid [German] [ACD/IUPAC Name]
N-[2-(2-Thienyl)ethyl]nicotinamide [ACD/IUPAC Name]
N-[2-(2-Thiényl)éthyl]nicotinamide [French] [ACD/IUPAC Name]
1088165-76-7 [RN]
AGN-PC-053MRQ
AKOS017069174
AO-854/43461983
MCULE-7361902703
MolPort-007-458-934
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 476.3±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.0±3.0 kJ/mol
    Flash Point: 241.8±24.6 °C
    Index of Refraction: 1.607
    Molar Refractivity: 65.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.69
    ACD/LogD (pH 5.5): 1.95
    ACD/BCF (pH 5.5): 17.83
    ACD/KOC (pH 5.5): 273.07
    ACD/LogD (pH 7.4): 1.95
    ACD/BCF (pH 7.4): 17.98
    ACD/KOC (pH 7.4): 275.28
    Polar Surface Area: 70 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 52.1±3.0 dyne/cm
    Molar Volume: 189.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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