ChemSpider 2D Image | (5S,6R,7R,10R)-7-[(2S)-1,2-Dihydroxy-2-propanyl]-6-hydroxy-3,10-dimethylspiro[4.5]dec-3-en-2-one | C15H24O4

(5S,6R,7R,10R)-7-[(2S)-1,2-Dihydroxy-2-propanyl]-6-hydroxy-3,10-dimethylspiro[4.5]dec-3-en-2-one

  • Molecular FormulaC15H24O4
  • Average mass268.349 Da
  • Monoisotopic mass268.167450 Da
  • ChemSpider ID78439453

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(5S,6R,7R,10R)-7-[(2S)-1,2-Dihydroxy-2-propanyl]-6-hydroxy-3,10-dimethylspiro[4.5]dec-3-en-2-on [German] [ACD/IUPAC Name]
(5S,6R,7R,10R)-7-[(2S)-1,2-Dihydroxy-2-propanyl]-6-hydroxy-3,10-dimethylspiro[4.5]dec-3-en-2-one [ACD/IUPAC Name]
(5S,6R,7R,10R)-7-[(2S)-1,2-Dihydroxy-2-propanyl]-6-hydroxy-3,10-diméthylspiro[4.5]déc-3-én-2-one [French] [ACD/IUPAC Name]
Spiro[4.5]dec-3-en-2-one, 7-[(1S)-1,2-dihydroxy-1-methylethyl]-6-hydroxy-3,10-dimethyl-, (5S,6R,7R,10R)- [ACD/Index Name]
Flammuspirone F

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

Density: 1.2±0.1 g/cm3
Boiling Point: 476.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.3±6.0 kJ/mol
Flash Point: 256.1±23.8 °C
Index of Refraction: 1.555
Molar Refractivity: 71.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 2.59
ACD/KOC (pH 5.5): 68.73
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 2.59
ACD/KOC (pH 7.4): 68.73
Polar Surface Area: 78 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 51.2±5.0 dyne/cm
Molar Volume: 223.7±5.0 cm3

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