ChemSpider 2D Image | 2-(1-Cyclohexen-1-yl)-N-[2-hydroxy-2-methyl-3-(methylsulfanyl)propyl]acetamide | C13H23NO2S

2-(1-Cyclohexen-1-yl)-N-[2-hydroxy-2-methyl-3-(methylsulfanyl)propyl]acetamide

  • Molecular FormulaC13H23NO2S
  • Average mass257.392 Da
  • Monoisotopic mass257.144958 Da
  • ChemSpider ID30472687

More details:

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

1-Cyclohexene-1-acetamide, N-[2-hydroxy-2-methyl-3-(methylthio)propyl]- [ACD/Index Name]
2-(1-Cyclohexen-1-yl)-N-[2-hydroxy-2-methyl-3-(methylsulfanyl)propyl]acetamid [German] [ACD/IUPAC Name]
2-(1-Cyclohexen-1-yl)-N-[2-hydroxy-2-methyl-3-(methylsulfanyl)propyl]acetamide [ACD/IUPAC Name]
2-(1-Cyclohexén-1-yl)-N-[2-hydroxy-2-méthyl-3-(méthylsulfanyl)propyl]acétamide [French] [ACD/IUPAC Name]
2-(CYCLOHEX-1-EN-1-YL)-N-[2-HYDROXY-2-METHYL-3-(METHYLSULFANYL)PROPYL]ACETAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 473.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.0±6.0 kJ/mol
Flash Point: 240.4±28.7 °C
Index of Refraction: 1.532
Molar Refractivity: 72.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 51.92
ACD/KOC (pH 5.5): 588.08
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.92
ACD/KOC (pH 7.4): 588.08
Polar Surface Area: 75 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 235.3±3.0 cm3

Click to predict properties on the Chemicalize site


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