ChemSpider 2D Image | 3-[(2-Amino-2-oxoethyl)sulfanyl]-N-(2-methylcyclohexyl)propanamide | C12H22N2O2S

3-[(2-Amino-2-oxoethyl)sulfanyl]-N-(2-methylcyclohexyl)propanamide

  • Molecular FormulaC12H22N2O2S
  • Average mass258.380 Da
  • Monoisotopic mass258.140198 Da
  • ChemSpider ID26206408

More details:

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

3-[(2-Amino-2-oxoethyl)sulfanyl]-N-(2-methylcyclohexyl)propanamid [German] [ACD/IUPAC Name]
3-[(2-Amino-2-oxoethyl)sulfanyl]-N-(2-methylcyclohexyl)propanamide [ACD/IUPAC Name]
3-[(2-Amino-2-oxoéthyl)sulfanyl]-N-(2-méthylcyclohexyl)propanamide [French] [ACD/IUPAC Name]
Propanamide, 3-[(2-amino-2-oxoethyl)thio]-N-(2-methylcyclohexyl)- [ACD/Index Name]
3-[(CARBAMOYLMETHYL)SULFANYL]-N-(2-METHYLCYCLOHEXYL)PROPANAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 507.0±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 260.4±28.2 °C
Index of Refraction: 1.533
Molar Refractivity: 71.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 7.79
ACD/KOC (pH 5.5): 151.34
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.80
ACD/KOC (pH 7.4): 151.34
Polar Surface Area: 97 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 46.5±5.0 dyne/cm
Molar Volume: 228.9±5.0 cm3

Click to predict properties on the Chemicalize site


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