ChemSpider 2D Image | 2,4-Dihydroxy-7-{[(2S)-2-hydroxy-3-methyl-3-buten-1-yl]oxy}-5-methoxy-9H-fluoren-9-one | C19H18O6

2,4-Dihydroxy-7-{[(2S)-2-hydroxy-3-methyl-3-buten-1-yl]oxy}-5-methoxy-9H-fluoren-9-one

  • Molecular FormulaC19H18O6
  • Average mass342.343 Da
  • Monoisotopic mass342.110352 Da
  • ChemSpider ID29419235

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2,4-Dihydroxy-7-{[(2S)-2-hydroxy-3-methyl-3-buten-1-yl]oxy}-5-methoxy-9H-fluoren-9-on [German] [ACD/IUPAC Name]
2,4-Dihydroxy-7-{[(2S)-2-hydroxy-3-methyl-3-buten-1-yl]oxy}-5-methoxy-9H-fluoren-9-one [ACD/IUPAC Name]
2,4-Dihydroxy-7-{[(2S)-2-hydroxy-3-méthyl-3-butén-1-yl]oxy}-5-méthoxy-9H-fluorén-9-one [French] [ACD/IUPAC Name]
9H-Fluoren-9-one, 2,4-dihydroxy-7-[[(2S)-2-hydroxy-3-methyl-3-buten-1-yl]oxy]-5-methoxy- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 624.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.2±3.0 kJ/mol
Flash Point: 228.9±25.0 °C
Index of Refraction: 1.650
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 2.53
ACD/BCF (pH 5.5): 48.82
ACD/KOC (pH 5.5): 561.80
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 33.57
ACD/KOC (pH 7.4): 386.36
Polar Surface Area: 96 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 248.5±3.0 cm3

Click to predict properties on the Chemicalize site


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