ChemSpider 2D Image | 2-[(4-Chlorophenyl)sulfanyl]-N-(1-isobutyl-4-piperidinyl)propanamide | C18H27ClN2OS

2-[(4-Chlorophenyl)sulfanyl]-N-(1-isobutyl-4-piperidinyl)propanamide

  • Molecular FormulaC18H27ClN2OS
  • Average mass354.938 Da
  • Monoisotopic mass354.153259 Da
  • ChemSpider ID29978522

More details:

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

2-[(4-Chlorophenyl)sulfanyl]-N-(1-isobutyl-4-piperidinyl)propanamide [ACD/IUPAC Name]
2-[(4-Chlorophényl)sulfanyl]-N-(1-isobutyl-4-pipéridinyl)propanamide [French] [ACD/IUPAC Name]
2-[(4-Chlorphenyl)sulfanyl]-N-(1-isobutyl-4-piperidinyl)propanamid [German] [ACD/IUPAC Name]
Propanamide, 2-[(4-chlorophenyl)thio]-N-[1-(2-methylpropyl)-4-piperidinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 500.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.4±30.1 °C
Index of Refraction: 1.573
Molar Refractivity: 100.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 1.94
ACD/KOC (pH 5.5): 8.31
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 53.33
ACD/KOC (pH 7.4): 228.47
Polar Surface Area: 58 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 46.5±5.0 dyne/cm
Molar Volume: 305.7±5.0 cm3

Click to predict properties on the Chemicalize site


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