ChemSpider 2D Image | 1-[(1S,3S)-3-Methyl-1-phenylcyclohexyl]piperidine | C18H27N

1-[(1S,3S)-3-Methyl-1-phenylcyclohexyl]piperidine

  • Molecular FormulaC18H27N
  • Average mass257.414 Da
  • Monoisotopic mass257.214355 Da
  • ChemSpider ID23138420

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-[(1S,3S)-3-Methyl-1-phenylcyclohexyl]piperidin [German] [ACD/IUPAC Name]
1-[(1S,3S)-3-Methyl-1-phenylcyclohexyl]piperidine [ACD/IUPAC Name]
1-[(1S,3S)-3-Méthyl-1-phénylcyclohexyl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-[(1S,3S)-3-methyl-1-phenylcyclohexyl]- [ACD/Index Name]
1-(3-Methyl-1-phenyl-cyclohexyl)-piperidine

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

Density: 1.0±0.1 g/cm3
Boiling Point: 349.5±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 149.4±16.2 °C
Index of Refraction: 1.538
Molar Refractivity: 81.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.38
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 30.98
ACD/KOC (pH 5.5): 75.49
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 1516.99
ACD/KOC (pH 7.4): 3697.00
Polar Surface Area: 3 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 260.2±3.0 cm3

Click to predict properties on the Chemicalize site


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