ChemSpider 2D Image | 1-(2-Naphthylsulfanyl)-1-(2-thienyl)-2-butanamine | C18H19NS2

1-(2-Naphthylsulfanyl)-1-(2-thienyl)-2-butanamine

  • Molecular FormulaC18H19NS2
  • Average mass313.480 Da
  • Monoisotopic mass313.095886 Da
  • ChemSpider ID39108070

More details:

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

1-(2-Naphthylsulfanyl)-1-(2-thienyl)-2-butanamin [German] [ACD/IUPAC Name]
1-(2-Naphthylsulfanyl)-1-(2-thienyl)-2-butanamine [ACD/IUPAC Name]
1-(2-Naphtylsulfanyl)-1-(2-thiényl)-2-butanamine [French] [ACD/IUPAC Name]
2-Thiopheneethanamine, α-ethyl-β-(2-naphthalenylthio)- [ACD/Index 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: 478.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 243.0±27.3 °C
Index of Refraction: 1.676
Molar Refractivity: 97.3±0.4 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 20.45
ACD/KOC (pH 5.5): 71.82
ACD/LogD (pH 7.4): 4.41
ACD/BCF (pH 7.4): 990.76
ACD/KOC (pH 7.4): 3479.43
Polar Surface Area: 80 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 55.5±5.0 dyne/cm
Molar Volume: 258.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement