ChemSpider 2D Image | (4S)-3-{[(1S,5S)-3,4-Dimethyl-2-oxo-5-propyl-3-cyclopenten-1-yl]carbonyl}-4-phenyl-1,3-oxazolidin-2-one | C20H23NO4

(4S)-3-{[(1S,5S)-3,4-Dimethyl-2-oxo-5-propyl-3-cyclopenten-1-yl]carbonyl}-4-phenyl-1,3-oxazolidin-2-one

  • Molecular FormulaC20H23NO4
  • Average mass341.401 Da
  • Monoisotopic mass341.162720 Da
  • ChemSpider ID30659291

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(4S)-3-{[(1S,5S)-3,4-Dimethyl-2-oxo-5-propyl-3-cyclopenten-1-yl]carbonyl}-4-phenyl-1,3-oxazolidin-2-on [German] [ACD/IUPAC Name]
(4S)-3-{[(1S,5S)-3,4-Dimethyl-2-oxo-5-propyl-3-cyclopenten-1-yl]carbonyl}-4-phenyl-1,3-oxazolidin-2-one [ACD/IUPAC Name]
(4S)-3-{[(1S,5S)-3,4-Diméthyl-2-oxo-5-propyl-3-cyclopentén-1-yl]carbonyl}-4-phényl-1,3-oxazolidin-2-one [French] [ACD/IUPAC Name]
2-Oxazolidinone, 3-[[(1S,5S)-3,4-dimethyl-2-oxo-5-propyl-3-cyclopenten-1-yl]carbonyl]-4-phenyl-, (4S)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 532.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 276.0±30.1 °C
Index of Refraction: 1.556
Molar Refractivity: 92.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 221.98
ACD/KOC (pH 5.5): 1663.81
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 221.85
ACD/KOC (pH 7.4): 1662.80
Polar Surface Area: 64 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 287.4±3.0 cm3

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