ChemSpider 2D Image | (5R,6R,7S,9S,10S)-6,9-Dihydroxy-3-(hydroxymethyl)-7-isopropyl-10-methylspiro[4.5]dec-3-en-2-one | C15H24O4

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

  • Molecular FormulaC15H24O4
  • Average mass268.349 Da
  • Monoisotopic mass268.167450 Da
  • ChemSpider ID78439440

  • 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-3-(hydroxymethyl)-7-isopropyl-10-methylspiro[4.5]dec-3-en-2-on [German] [ACD/IUPAC Name]
(5R,6R,7S,9S,10S)-6,9-Dihydroxy-3-(hydroxymethyl)-7-isopropyl-10-methylspiro[4.5]dec-3-en-2-one [ACD/IUPAC Name]
(5R,6R,7S,9S,10S)-6,9-Dihydroxy-3-(hydroxyméthyl)-7-isopropyl-10-méthylspiro[4.5]déc-3-én-2-one [French] [ACD/IUPAC Name]
Spiro[4.5]dec-3-en-2-one, 6,9-dihydroxy-3-(hydroxymethyl)-10-methyl-7-(1-methylethyl)-, (5R,6R,7S,9S,10S)- [ACD/Index Name]
Flammuspirone H

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

Density: 1.2±0.1 g/cm3
Boiling Point: 471.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 84.6±6.0 kJ/mol
Flash Point: 252.8±25.2 °C
Index of Refraction: 1.552
Molar Refractivity: 71.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 9.07
ACD/KOC (pH 5.5): 168.71
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 9.07
ACD/KOC (pH 7.4): 168.71
Polar Surface Area: 78 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 224.5±5.0 cm3

Click to predict properties on the Chemicalize site


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