ChemSpider 2D Image | 4-[4-(Benzyloxy)phenyl]-1-[(1S)-1-phenylethyl]-1,2,3,6-tetrahydropyridine | C26H27NO

4-[4-(Benzyloxy)phenyl]-1-[(1S)-1-phenylethyl]-1,2,3,6-tetrahydropyridine

  • Molecular FormulaC26H27NO
  • Average mass369.499 Da
  • Monoisotopic mass369.209259 Da
  • ChemSpider ID78272976

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-[4-(Benzyloxy)phenyl]-1-[(1S)-1-phenylethyl]-1,2,3,6-tetrahydropyridin [German] [ACD/IUPAC Name]
4-[4-(Benzyloxy)phenyl]-1-[(1S)-1-phenylethyl]-1,2,3,6-tetrahydropyridine [ACD/IUPAC Name]
4-[4-(Benzyloxy)phényl]-1-[(1S)-1-phényléthyl]-1,2,3,6-tétrahydropyridine [French] [ACD/IUPAC Name]
Pyridine, 1,2,3,6-tetrahydro-1-[(1S)-1-phenylethyl]-4-[4-(phenylmethoxy)phenyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 507.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 146.6±32.4 °C
Index of Refraction: 1.611
Molar Refractivity: 115.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 41.92
ACD/KOC (pH 5.5): 112.15
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2110.76
ACD/KOC (pH 7.4): 5646.93
Polar Surface Area: 12 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 333.2±3.0 cm3

Click to predict properties on the Chemicalize site


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