ChemSpider 2D Image | 3-[Dodecyl(ethyl)amino]propanethioamide | C17H36N2S

3-[Dodecyl(ethyl)amino]propanethioamide

  • Molecular FormulaC17H36N2S
  • Average mass300.546 Da
  • Monoisotopic mass300.259918 Da
  • ChemSpider ID43137300

More details:

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

3-[Dodecyl(ethyl)amino]propanethioamide [ACD/IUPAC Name]
3-[Dodécyl(éthyl)amino]propanethioamide [French] [ACD/IUPAC Name]
3-[Dodecyl(ethyl)amino]propanthioamid [German] [ACD/IUPAC Name]
Propanethioamide, 3-(dodecylethylamino)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 399.8±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 195.6±28.4 °C
Index of Refraction: 1.498
Molar Refractivity: 95.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 6.27
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 30.15
ACD/KOC (pH 5.5): 59.39
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 842.82
ACD/KOC (pH 7.4): 1659.95
Polar Surface Area: 61 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 325.1±3.0 cm3

Click to predict properties on the Chemicalize site


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