ChemSpider 2D Image | N-(Di-2-thienylmethyl)-1-(4-methylphenyl)ethanamine | C18H19NS2

N-(Di-2-thienylmethyl)-1-(4-methylphenyl)ethanamine

  • Molecular FormulaC18H19NS2
  • Average mass313.480 Da
  • Monoisotopic mass313.095886 Da
  • ChemSpider ID38657514

More details:

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

1183873-05-3 [RN]
2-Thiophenemethanamine, N-[1-(4-methylphenyl)ethyl]-α-2-thienyl- [ACD/Index Name]
N-(Di-2-thienylmethyl)-1-(4-methylphenyl)ethanamin [German] [ACD/IUPAC Name]
N-(Di-2-thienylmethyl)-1-(4-methylphenyl)ethanamine [ACD/IUPAC Name]
N-(Di-2-thiénylméthyl)-1-(4-méthylphényl)éthanamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 434.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.6±27.3 °C
Index of Refraction: 1.623
Molar Refractivity: 94.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 143.20
ACD/KOC (pH 5.5): 471.22
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 2981.46
ACD/KOC (pH 7.4): 9811.03
Polar Surface Area: 69 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 268.1±3.0 cm3

Click to predict properties on the Chemicalize site


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