ChemSpider 2D Image | N-[2-(Methylsulfanyl)phenyl]-3-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}propanamide | C19H21NOS2

N-[2-(Methylsulfanyl)phenyl]-3-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}propanamide

  • Molecular FormulaC19H21NOS2
  • Average mass343.506 Da
  • Monoisotopic mass343.106445 Da
  • ChemSpider ID22856963
  • Double-bond stereo - Double-bond stereo


More details:






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

N-[2-(Methylsulfanyl)phenyl]-3-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}propanamid [German] [ACD/IUPAC Name]
N-[2-(Methylsulfanyl)phenyl]-3-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}propanamide [ACD/IUPAC Name]
N-[2-(Méthylsulfanyl)phényl]-3-{[(2E)-3-phényl-2-propén-1-yl]sulfanyl}propanamide [French] [ACD/IUPAC Name]
Propanamide, N-[2-(methylthio)phenyl]-3-[[(2E)-3-phenyl-2-propen-1-yl]thio]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 565.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.6±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 103.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 2326.02
ACD/KOC (pH 5.5): 8941.60
ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 7.4): 2326.06
ACD/KOC (pH 7.4): 8941.77
Polar Surface Area: 80 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 52.8±5.0 dyne/cm
Molar Volume: 290.1±5.0 cm3

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