ChemSpider 2D Image | (4R,5aR,8R,8aS)-8-Hydroxy-4,7,7-trimethyl-3,4,5,5a,6,7,8,8a-octahydro-1H-indeno[4,5-c]furan-1-one | C14H20O3

(4R,5aR,8R,8aS)-8-Hydroxy-4,7,7-trimethyl-3,4,5,5a,6,7,8,8a-octahydro-1H-indeno[4,5-c]furan-1-one

  • Molecular FormulaC14H20O3
  • Average mass236.307 Da
  • Monoisotopic mass236.141251 Da
  • ChemSpider ID78438447

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(4R,5aR,8R,8aS)-8-Hydroxy-4,7,7-trimethyl-3,4,5,5a,6,7,8,8a-octahydro-1H-indeno[4,5-c]furan-1-on [German] [ACD/IUPAC Name]
(4R,5aR,8R,8aS)-8-Hydroxy-4,7,7-trimethyl-3,4,5,5a,6,7,8,8a-octahydro-1H-indeno[4,5-c]furan-1-one [ACD/IUPAC Name]
(4R,5aR,8R,8aS)-8-Hydroxy-4,7,7-triméthyl-3,4,5,5a,6,7,8,8a-octahydro-1H-indéno[4,5-c]furan-1-one [French] [ACD/IUPAC Name]
1H-Indeno[4,5-c]furan-1-one, 3,4,5,5a,6,7,8,8a-octahydro-8-hydroxy-4,7,7-trimethyl-, (4R,5aR,8R,8aS)- [ACD/Index Name]
Flammulinolide D

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

Density: 1.2±0.1 g/cm3
Boiling Point: 410.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.6±6.0 kJ/mol
Flash Point: 176.3±18.2 °C
Index of Refraction: 1.548
Molar Refractivity: 63.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 19.91
ACD/KOC (pH 5.5): 296.12
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 19.91
ACD/KOC (pH 7.4): 296.12
Polar Surface Area: 47 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 43.3±5.0 dyne/cm
Molar Volume: 200.0±5.0 cm3

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