ChemSpider 2D Image | (5S,6R,7R,10R)-6-Hydroxy-7-(2-hydroxy-2-propanyl)-3,10-dimethylspiro[4.5]dec-3-en-2-one | C15H24O3

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

  • Molecular FormulaC15H24O3
  • Average mass252.349 Da
  • Monoisotopic mass252.172546 Da
  • ChemSpider ID78439450

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 409.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.4±6.0 kJ/mol
Flash Point: 215.5±23.3 °C
Index of Refraction: 1.533
Molar Refractivity: 70.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 23.92
ACD/KOC (pH 5.5): 337.68
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 23.92
ACD/KOC (pH 7.4): 337.68
Polar Surface Area: 58 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 43.6±5.0 dyne/cm
Molar Volume: 226.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement