ChemSpider 2D Image | Ethyl {(2R,5R)-5-[(1R,2E)-1-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-3-iodo-2-propen-1-yl]tetrahydro-2-furanyl}acetate | C17H31IO4Si

Ethyl {(2R,5R)-5-[(1R,2E)-1-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-3-iodo-2-propen-1-yl]tetrahydro-2-furanyl}acetate

  • Molecular FormulaC17H31IO4Si
  • Average mass454.416 Da
  • Monoisotopic mass454.103607 Da
  • ChemSpider ID30992567
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres


More details:






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

{(2R,5R)-5-[(1R,2E)-1-{[Diméthyl(2-méthyl-2-propanyl)silyl]oxy}-3-iodo-2-propén-1-yl]tétrahydro-2-furanyl}acétate d'éthyle [French] [ACD/IUPAC Name]
2-Furanacetic acid, 5-[(1R,2E)-1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3-iodo-2-propen-1-yl]tetrahydro-, ethyl ester, (2R,5R)- [ACD/Index Name]
Ethyl {(2R,5R)-5-[(1R,2E)-1-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-3-iodo-2-propen-1-yl]tetrahydro-2-furanyl}acetate [ACD/IUPAC Name]
Ethyl-{(2R,5R)-5-[(1R,2E)-1-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-3-iod-2-propen-1-yl]tetrahydro-2-furanyl}acetat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 416.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.9±3.0 kJ/mol
Flash Point: 205.4±24.6 °C
Index of Refraction: 1.499
Molar Refractivity: 105.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.47
ACD/LogD (pH 5.5): 5.47
ACD/BCF (pH 5.5): 8527.98
ACD/KOC (pH 5.5): 22661.57
ACD/LogD (pH 7.4): 5.47
ACD/BCF (pH 7.4): 8527.98
ACD/KOC (pH 7.4): 22661.57
Polar Surface Area: 45 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 359.6±3.0 cm3

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