ChemSpider 2D Image | (2S)-1-(3-Methoxyphenyl)-2-(1-piperidinyl)-1-propanone | C15H21NO2

(2S)-1-(3-Methoxyphenyl)-2-(1-piperidinyl)-1-propanone

  • Molecular FormulaC15H21NO2
  • Average mass247.333 Da
  • Monoisotopic mass247.157227 Da
  • ChemSpider ID57642843

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(3-Methoxyphenyl)-2-(1-piperidinyl)-1-propanon [German] [ACD/IUPAC Name]
(2S)-1-(3-Methoxyphenyl)-2-(1-piperidinyl)-1-propanone [ACD/IUPAC Name]
(2S)-1-(3-Méthoxyphényl)-2-(1-pipéridinyl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-(3-methoxyphenyl)-2-(1-piperidinyl)-, (2S)- [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: 361.6±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.8±3.0 kJ/mol
Flash Point: 172.5±22.3 °C
Index of Refraction: 1.531
Molar Refractivity: 72.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 5.48
ACD/KOC (pH 5.5): 62.62
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 45.72
ACD/KOC (pH 7.4): 522.08
Polar Surface Area: 30 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 233.0±3.0 cm3

Click to predict properties on the Chemicalize site


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