ChemSpider 2D Image | (4S,6R)-2,2,6-Trimethyl-4-piperidinyl benzoate | C15H21NO2

(4S,6R)-2,2,6-Trimethyl-4-piperidinyl benzoate

  • Molecular FormulaC15H21NO2
  • Average mass247.333 Da
  • Monoisotopic mass247.157227 Da
  • ChemSpider ID34987475

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4S,6R)-2,2,6-Trimethyl-4-piperidinyl benzoate [ACD/IUPAC Name]
(4S,6R)-2,2,6-Trimethyl-4-piperidinyl-benzoat [German] [ACD/IUPAC Name]
4-Piperidinol, 2,2,6-trimethyl-, benzoate (ester), (4S,6R)- [ACD/Index Name]
Benzoate de (4S,6R)-2,2,6-triméthyl-4-pipéridinyle [French] [ACD/IUPAC Name]
[(4R,6S)-2,2,6-trimethyl-4-piperidyl] benzoate
[(4R,6S)-2,2,6-trimethylpiperidin-4-yl] benzoate
500-34-5 [RN]
benzoic acid [(4R,6S)-2,2,6-trimethyl-4-piperidinyl] ester
benzoic acid [(4R,6S)-2,2,6-trimethyl-4-piperidyl] ester
Eucaine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 332.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.5±3.0 kJ/mol
Flash Point: 154.9±25.9 °C
Index of Refraction: 1.533
Molar Refractivity: 71.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 0.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.71
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.74
Polar Surface Area: 38 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 39.5±5.0 dyne/cm
Molar Volume: 231.6±5.0 cm3

Click to predict properties on the Chemicalize site


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