ChemSpider 2D Image | (S)-8-benzyloxy-5-oxiranyl-1H-quinolin-2-one | C18H15NO3

(S)-8-benzyloxy-5-oxiranyl-1H-quinolin-2-one

  • Molecular FormulaC18H15NO3
  • Average mass293.317 Da
  • Monoisotopic mass293.105194 Da
  • ChemSpider ID79715436

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-8-benzyloxy-5-oxiranyl-1H-quinolin-2-one
2(1H)-Quinolinone, 5-[(2S)-oxiranyl]-8-(phenylmethoxy)- [ACD/Index Name]
312753-76-7 [RN]
8-(Benzyloxy)-5-[(2S)-2-oxiranyl]-2(1H)-chinolinon [German] [ACD/IUPAC Name]
8-(Benzyloxy)-5-[(2S)-2-oxiranyl]-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
8-(Benzyloxy)-5-[(2S)-2-oxiranyl]-2(1H)-quinolinone [ACD/IUPAC Name]
(S)-8-(Benzyloxy)-5-(oxiran-2-yl)quinolin-2(1H)-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 556.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 290.0±30.1 °C
Index of Refraction: 1.643
Molar Refractivity: 81.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 28.06
ACD/KOC (pH 5.5): 378.59
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 28.05
ACD/KOC (pH 7.4): 378.48
Polar Surface Area: 51 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 225.8±3.0 cm3

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