ChemSpider 2D Image | Bis{[(1aR,4E,7aS,10aS,10bS)-1a-methyl-8-methylene-9-oxo-1a,2,3,6,7,7a,8,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-5-yl]methyl} 1,5-pentanediylbiscarbamate | C37H50N2O10

Bis{[(1aR,4E,7aS,10aS,10bS)-1a-methyl-8-methylene-9-oxo-1a,2,3,6,7,7a,8,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-5-yl]methyl} 1,5-pentanediylbiscarbamate

  • Molecular FormulaC37H50N2O10
  • Average mass682.800 Da
  • Monoisotopic mass682.346558 Da
  • ChemSpider ID58914282

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

1,5-Pentanediylbiscarbamate de bis{[(1aR,4E,7aS,10aS,10bS)-1a-méthyl-8-méthylène-9-oxo-1a,2,3,6,7,7a,8,9,10a,10b-décahydrooxiréno[9,10]cyclodéca[1,2-b]furan-5-yl]méthyle} [French] [ACD/IUPAC Name]
Bis{[(1aR,4E,7aS,10aS,10bS)-1a-methyl-8-methylen-9-oxo-1a,2,3,6,7,7a,8,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-5-yl]methyl}-1,5-pentandiylbiscarbamat [German] [ACD/IUPAC Name]
Bis{[(1aR,4E,7aS,10aS,10bS)-1a-methyl-8-methylene-9-oxo-1a,2,3,6,7,7a,8,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-5-yl]methyl} 1,5-pentanediylbiscarbamate [ACD/IUPAC Name]
Carbamic acid, N,N'-1,5-pentanediylbis-, bis[[(1aR,4E,7aS,10aS,10bS)-1a,2,3,6,7,7a,8,9,10a,10b-decahydro-1a-methyl-8-methylene-9-oxooxireno[9,10]cyclodeca[1,2-b]furan-5-yl]methyl] ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 855.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.3±3.0 kJ/mol
Flash Point: 471.0±34.3 °C
Index of Refraction: 1.575
Molar Refractivity: 177.7±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 755.85
ACD/KOC (pH 5.5): 3999.33
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 755.84
ACD/KOC (pH 7.4): 3999.28
Polar Surface Area: 154 Å2
Polarizability: 70.4±0.5 10-24cm3
Surface Tension: 53.4±5.0 dyne/cm
Molar Volume: 537.7±5.0 cm3

Click to predict properties on the Chemicalize site


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