ChemSpider 2D Image | (5R,6R,7S,9S,10S)-6,9-Dihydroxy-7-isopropenyl-3,10-dimethylspiro[4.5]dec-3-en-2-one | C15H22O3

(5R,6R,7S,9S,10S)-6,9-Dihydroxy-7-isopropenyl-3,10-dimethylspiro[4.5]dec-3-en-2-one

  • Molecular FormulaC15H22O3
  • Average mass250.333 Da
  • Monoisotopic mass250.156891 Da
  • ChemSpider ID78439442

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(5R,6R,7S,9S,10S)-6,9-Dihydroxy-7-isopropenyl-3,10-dimethylspiro[4.5]dec-3-en-2-on [German] [ACD/IUPAC Name]
(5R,6R,7S,9S,10S)-6,9-Dihydroxy-7-isopropenyl-3,10-dimethylspiro[4.5]dec-3-en-2-one [ACD/IUPAC Name]
(5R,6R,7S,9S,10S)-6,9-Dihydroxy-7-isopropényl-3,10-diméthylspiro[4.5]déc-3-én-2-one [French] [ACD/IUPAC Name]
Spiro[4.5]dec-3-en-2-one, 6,9-dihydroxy-3,10-dimethyl-7-(1-methylethenyl)-, (5R,6R,7S,9S,10S)- [ACD/Index Name]
Flammuspirone J

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

Density: 1.1±0.1 g/cm3
Boiling Point: 392.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 74.3±6.0 kJ/mol
Flash Point: 205.4±24.4 °C
Index of Refraction: 1.542
Molar Refractivity: 69.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.26
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 26.55
ACD/KOC (pH 5.5): 363.90
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.55
ACD/KOC (pH 7.4): 363.90
Polar Surface Area: 58 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 43.3±5.0 dyne/cm
Molar Volume: 221.6±5.0 cm3

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