ChemSpider 2D Image | 9-Heptadecanyl 5-oxo-L-prolinate | C22H41NO3

9-Heptadecanyl 5-oxo-L-prolinate

  • Molecular FormulaC22H41NO3
  • Average mass367.566 Da
  • Monoisotopic mass367.308655 Da
  • ChemSpider ID21230089

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

253-600-1 [EINECS]
37673-32-8 [RN]
5-Oxo-L-prolinate de 9-heptadécanyle [French] [ACD/IUPAC Name]
5-Oxo-L-proline 1-octylnonyl ester
9-Heptadecanyl 5-oxo-L-prolinate [ACD/IUPAC Name]
9-Heptadecanyl-5-oxo-L-prolinat [German] [ACD/IUPAC Name]
Heptadecan-9-yl 5-oxo-L-prolinate
L-Proline, 5-oxo-, 1-octylnonyl ester [ACD/Index Name]
1-octylnonyl 5-oxo-L-prolinate
HEPTADECAN-9-YL (2S)-5-OXOPYRROLIDINE-2-CARBOXYLATE

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

Density: 1.0±0.1 g/cm3
Boiling Point: 495.5±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.5±26.8 °C
Index of Refraction: 1.470
Molar Refractivity: 107.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 6.69
ACD/BCF (pH 5.5): 71839.27
ACD/KOC (pH 5.5): 104175.14
ACD/LogD (pH 7.4): 6.69
ACD/BCF (pH 7.4): 71839.27
ACD/KOC (pH 7.4): 104175.14
Polar Surface Area: 55 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 383.3±3.0 cm3

Click to predict properties on the Chemicalize site


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