ChemSpider 2D Image | (3S)-3-(3,4-Dichlorophenoxy)piperidine | C11H13Cl2NO

(3S)-3-(3,4-Dichlorophenoxy)piperidine

  • Molecular FormulaC11H13Cl2NO
  • Average mass246.133 Da
  • Monoisotopic mass245.037415 Da
  • ChemSpider ID113079088

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(3,4-Dichlorophenoxy)piperidine [ACD/IUPAC Name]
(3S)-3-(3,4-Dichlorophénoxy)pipéridine [French] [ACD/IUPAC Name]
(3S)-3-(3,4-Dichlorphenoxy)piperidin [German] [ACD/IUPAC Name]
Piperidine, 3-(3,4-dichlorophenoxy)-, (3S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 346.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 163.2±27.9 °C
Index of Refraction: 1.551
Molar Refractivity: 62.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.17
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 7.57
ACD/KOC (pH 7.4): 54.11
Polar Surface Area: 21 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 195.9±3.0 cm3

Click to predict properties on the Chemicalize site


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