ChemSpider 2D Image | (3S)-3-(Cyclohexylmethyl)pyrrolidine | C11H21N

(3S)-3-(Cyclohexylmethyl)pyrrolidine

  • Molecular FormulaC11H21N
  • Average mass167.291 Da
  • Monoisotopic mass167.167404 Da
  • ChemSpider ID32805800

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(Cyclohexylmethyl)pyrrolidin [German] [ACD/IUPAC Name]
(3S)-3-(Cyclohexylmethyl)pyrrolidine [ACD/IUPAC Name]
(3S)-3-(Cyclohexylméthyl)pyrrolidine [French] [ACD/IUPAC Name]
Pyrrolidine, 3-(cyclohexylmethyl)-, (3S)- [ACD/Index Name]
1335706-41-6 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 240.8±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.8±3.0 kJ/mol
Flash Point: 96.7±16.5 °C
Index of Refraction: 1.476
Molar Refractivity: 52.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.08
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.12
Polar Surface Area: 12 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 33.5±3.0 dyne/cm
Molar Volume: 184.8±3.0 cm3

Click to predict properties on the Chemicalize site


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