ChemSpider 2D Image | N,N-Dimethyl-1-[4-(methylsulfanyl)phenyl]-2-propanamine | C12H19NS

N,N-Dimethyl-1-[4-(methylsulfanyl)phenyl]-2-propanamine

  • Molecular FormulaC12H19NS
  • Average mass209.351 Da
  • Monoisotopic mass209.123825 Da
  • ChemSpider ID24657499

More details:

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

Benzeneethanamine, N,N,α-trimethyl-4-(methylthio)- [ACD/Index Name]
N,N-Dimethyl-1-[4-(methylsulfanyl)phenyl]-2-propanamin [German] [ACD/IUPAC Name]
N,N-Dimethyl-1-[4-(methylsulfanyl)phenyl]-2-propanamine [ACD/IUPAC Name]
N,N-Diméthyl-1-[4-(méthylsulfanyl)phényl]-2-propanamine [French] [ACD/IUPAC Name]
N,N-dimethyl-1-[4-(methylsulfanyl)phenyl]propan-2-amine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 295.7±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.5±3.0 kJ/mol
Flash Point: 132.6±25.4 °C
Index of Refraction: 1.547
Molar Refractivity: 66.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.74
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 2.47
ACD/KOC (pH 7.4): 17.45
Polar Surface Area: 29 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 37.6±5.0 dyne/cm
Molar Volume: 209.5±5.0 cm3

Click to predict properties on the Chemicalize site


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