ChemSpider 2D Image | 8-Hydroxy-5-[(2S)-1-hydroxy-2-(isopropylamino)butyl]-2(1H)-quinolinone | C16H22N2O3

8-Hydroxy-5-[(2S)-1-hydroxy-2-(isopropylamino)butyl]-2(1H)-quinolinone

  • Molecular FormulaC16H22N2O3
  • Average mass290.358 Da
  • Monoisotopic mass290.163055 Da
  • ChemSpider ID73975460

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

2(1H)-Quinolinone, 8-hydroxy-5-[(2S)-1-hydroxy-2-[(1-methylethyl)amino]butyl]- [ACD/Index Name]
8-Hydroxy-5-[(2S)-1-hydroxy-2-(isopropylamino)butyl]-2(1H)-chinolinon [German] [ACD/IUPAC Name]
8-Hydroxy-5-[(2S)-1-hydroxy-2-(isopropylamino)butyl]-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
8-Hydroxy-5-[(2S)-1-hydroxy-2-(isopropylamino)butyl]-2(1H)-quinolinone [ACD/IUPAC 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: 539.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.0±3.0 kJ/mol
Flash Point: 280.1±30.1 °C
Index of Refraction: 1.580
Molar Refractivity: 81.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.37
ACD/LogD (pH 5.5): -1.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.13
Polar Surface Area: 82 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 243.7±3.0 cm3

Click to predict properties on the Chemicalize site


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