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ChemSpider 2D Image | N-Methoxy-N-methyl-1-[4-(methylsulfanyl)phenyl]-2-propanamine | C12H19NOS

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

  • Molecular FormulaC12H19NOS
  • Average mass225.350 Da
  • Monoisotopic mass225.118729 Da
  • ChemSpider ID24657500

More details:






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

Benzeneethanamine, N-methoxy-N,α-dimethyl-4-(methylthio)- [ACD/Index Name]
N-Methoxy-N-methyl-1-[4-(methylsulfanyl)phenyl]-2-propanamin [German] [ACD/IUPAC Name]
N-Methoxy-N-methyl-1-[4-(methylsulfanyl)phenyl]-2-propanamine [ACD/IUPAC Name]
N-Méthoxy-N-méthyl-1-[4-(méthylsulfanyl)phényl]-2-propanamine [French] [ACD/IUPAC Name]
1204749-04-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 314.3±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 143.9±30.7 °C
Index of Refraction: 1.544
Molar Refractivity: 68.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 108.90
ACD/KOC (pH 5.5): 996.06
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 110.15
ACD/KOC (pH 7.4): 1007.52
Polar Surface Area: 38 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 39.0±5.0 dyne/cm
Molar Volume: 215.8±5.0 cm3

Click to predict properties on the Chemicalize site






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