ChemSpider 2D Image | (4R,5aR,8aR)-8a-Hydroxy-4,7,7-trimethyl-4,5,5a,6,7,8a-hexahydro-1H-indeno[4,5-c]furan-1,8(3H)-dione | C14H18O4

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

  • Molecular FormulaC14H18O4
  • Average mass250.290 Da
  • Monoisotopic mass250.120514 Da
  • ChemSpider ID78437614

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(4R,5aR,8aR)-8a-Hydroxy-4,7,7-trimethyl-4,5,5a,6,7,8a-hexahydro-1H-indeno[4,5-c]furan-1,8(3H)-dion [German] [ACD/IUPAC Name]
(4R,5aR,8aR)-8a-Hydroxy-4,7,7-trimethyl-4,5,5a,6,7,8a-hexahydro-1H-indeno[4,5-c]furan-1,8(3H)-dione [ACD/IUPAC Name]
(4R,5aR,8aR)-8a-Hydroxy-4,7,7-triméthyl-4,5,5a,6,7,8a-hexahydro-1H-indéno[4,5-c]furane-1,8(3H)-dione [French] [ACD/IUPAC Name]
1H-Indeno[4,5-c]furan-1,8(3H)-dione, 4,5,5a,6,7,8a-hexahydro-8a-hydroxy-4,7,7-trimethyl-, (4R,5aR,8aR)- [ACD/Index Name]
Flammulinolide C

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

Density: 1.3±0.1 g/cm3
Boiling Point: 458.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.0±6.0 kJ/mol
Flash Point: 176.5±22.2 °C
Index of Refraction: 1.563
Molar Refractivity: 63.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 6.72
ACD/KOC (pH 5.5): 136.15
ACD/LogD (pH 7.4): 1.39
ACD/BCF (pH 7.4): 6.72
ACD/KOC (pH 7.4): 136.14
Polar Surface Area: 64 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 48.8±5.0 dyne/cm
Molar Volume: 196.2±5.0 cm3

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