ChemSpider 2D Image | N-(Adamantan-1-yl)-2-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}acetamide | C21H27NOS

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

  • Molecular FormulaC21H27NOS
  • Average mass341.510 Da
  • Monoisotopic mass341.181335 Da
  • ChemSpider ID31054800
  • Double-bond stereo - Double-bond stereo


More details:






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

Acetamide, 2-[[(2E)-3-phenyl-2-propen-1-yl]thio]-N-tricyclo[3.3.1.13,7]dec-1-yl- [ACD/Index Name]
N-(Adamantan-1-yl)-2-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}acetamid [German] [ACD/IUPAC Name]
N-(Adamantan-1-yl)-2-{[(2E)-3-phenyl-2-propen-1-yl]sulfanyl}acetamide [ACD/IUPAC Name]
N-(Adamantan-1-yl)-2-{[(2E)-3-phényl-2-propén-1-yl]sulfanyl}acétamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 547.9±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 285.2±27.1 °C
Index of Refraction: 1.611
Molar Refractivity: 101.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.92
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 1924.34
ACD/KOC (pH 5.5): 7807.04
ACD/LogD (pH 7.4): 4.62
ACD/BCF (pH 7.4): 1924.35
ACD/KOC (pH 7.4): 7807.05
Polar Surface Area: 54 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 293.2±5.0 cm3

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