ChemSpider 2D Image | 4-[(4-Methylphenyl)sulfanyl]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]butanamide | C23H27F3N2OS

4-[(4-Methylphenyl)sulfanyl]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]butanamide

  • Molecular FormulaC23H27F3N2OS
  • Average mass436.534 Da
  • Monoisotopic mass436.179626 Da
  • ChemSpider ID67783291

More details:

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

4-[(4-Methylphenyl)sulfanyl]-N-[2-(1-piperidinyl)-5-(trifluormethyl)phenyl]butanamid [German] [ACD/IUPAC Name]
4-[(4-Methylphenyl)sulfanyl]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]butanamide [ACD/IUPAC Name]
4-[(4-Méthylphényl)sulfanyl]-N-[2-(1-pipéridinyl)-5-(trifluorométhyl)phényl]butanamide [French] [ACD/IUPAC Name]
Butanamide, 4-[(4-methylphenyl)thio]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]- [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: 577.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 303.3±30.1 °C
Index of Refraction: 1.580
Molar Refractivity: 116.4±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.92
ACD/LogD (pH 5.5): 6.22
ACD/BCF (pH 5.5): 30921.95
ACD/KOC (pH 5.5): 56538.11
ACD/LogD (pH 7.4): 6.23
ACD/BCF (pH 7.4): 31768.28
ACD/KOC (pH 7.4): 58085.55
Polar Surface Area: 58 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 349.6±5.0 cm3

Click to predict properties on the Chemicalize site


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