ChemSpider 2D Image | N-(2-Methoxyethyl)-1-[4-(methylsulfanyl)phenyl]-2-propanamine | C13H21NOS

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

  • Molecular FormulaC13H21NOS
  • Average mass239.377 Da
  • Monoisotopic mass239.134384 Da
  • ChemSpider ID24657498

More details:

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

Benzeneethanamine, N-(2-methoxyethyl)-α-methyl-4-(methylthio)- [ACD/Index Name]
N-(2-Methoxyethyl)-1-[4-(methylsulfanyl)phenyl]-2-propanamin [German] [ACD/IUPAC Name]
N-(2-Methoxyethyl)-1-[4-(methylsulfanyl)phenyl]-2-propanamine [ACD/IUPAC Name]
N-(2-Méthoxyéthyl)-1-[4-(méthylsulfanyl)phényl]-2-propanamine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 340.5±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.4±3.0 kJ/mol
Flash Point: 159.7±23.7 °C
Index of Refraction: 1.534
Molar Refractivity: 72.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.51
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.07
ACD/BCF (pH 7.4): 1.52
ACD/KOC (pH 7.4): 15.62
Polar Surface Area: 47 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 38.5±5.0 dyne/cm
Molar Volume: 233.3±5.0 cm3

Click to predict properties on the Chemicalize site


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