ChemSpider 2D Image | (2S)-1-Methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine | C18H29N

(2S)-1-Methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine

  • Molecular FormulaC18H29N
  • Average mass259.430 Da
  • Monoisotopic mass259.230011 Da
  • ChemSpider ID25058145

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S)-1-Methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidin [German] [ACD/IUPAC Name]
(2S)-1-Methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine [ACD/IUPAC Name]
(2S)-1-Méthyl-2-[(2S,4R)-2-méthyl-4-phénylpentyl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]-, (2S)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 338.4±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 143.7±16.2 °C
Index of Refraction: 1.503
Molar Refractivity: 83.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 5.68
ACD/KOC (pH 5.5): 16.05
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 22.66
ACD/KOC (pH 7.4): 64.00
Polar Surface Area: 3 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 32.4±3.0 dyne/cm
Molar Volume: 282.9±3.0 cm3

Click to predict properties on the Chemicalize site


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