ChemSpider 2D Image | {(2R,2'R,5'R,6'S,8a'S)-6'-(Formyloxy)-5-[2-(formyloxy)ethyl]-2',5',8a'-trimethyldecahydro-2'H,3H-spiro[furan-2,1'-naphthalene]-5,5'-diyl}bis(methylene) diformate | C24H36O9

{(2R,2'R,5'R,6'S,8a'S)-6'-(Formyloxy)-5-[2-(formyloxy)ethyl]-2',5',8a'-trimethyldecahydro-2'H,3H-spiro[furan-2,1'-naphthalene]-5,5'-diyl}bis(methylene) diformate

  • Molecular FormulaC24H36O9
  • Average mass468.537 Da
  • Monoisotopic mass468.235931 Da
  • ChemSpider ID71292517

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

{(2R,2'R,5'R,6'S,8a'S)-6'-(Formyloxy)-5-[2-(formyloxy)ethyl]-2',5',8a'-trimethyldecahydro-2'H,3H-spiro[furan-2,1'-naphthalene]-5,5'-diyl}bis(methylene) diformate [ACD/IUPAC Name]
{(2R,2'R,5'R,6'S,8a'S)-6'-(Formyloxy)-5-[2-(formyloxy)ethyl]-2',5',8a'-trimethyldecahydro-2'H,3H-spiro[furan-2,1'-naphthalene]-5,5'-diyl}dimethylendiformiat [German] [ACD/IUPAC Name]
Diformiate de {(2R,2'R,5'R,6'S,8a'S)-6'-(formyloxy)-5-[2-(formyloxy)éthyl]-2',5',8a'-triméthyldécahydro-2'H,3H-spiro[furan-2,1'-naphthalene]-5,5'-diyl}diméthylène [French] [ACD/IUPAC Name]
Spiro[furan-2(3H),1'(2'H)-naphthalene]-5,5'-dimethanol, 6'-(formyloxy)-5-[2-(formyloxy)ethyl]decahydro-2',5',8'a-trimethyl-, diformate, (2R,2'R,5'R,6'S,8'aS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 550.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.1±3.0 kJ/mol
Flash Point: 234.1±26.0 °C
Index of Refraction: 1.516
Molar Refractivity: 117.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 2.64
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 105.05
ACD/KOC (pH 5.5): 973.96
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 105.05
ACD/KOC (pH 7.4): 973.96
Polar Surface Area: 114 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 387.6±5.0 cm3

Click to predict properties on the Chemicalize site


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