ChemSpider 2D Image | 2-Ethyl 1-methyl (1R,2S,3S)-1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-{(1Z)-3-oxo-3-[(triisopropylsilyl)oxy]-1-propen-1-yl}-1,2-cyclopropanedicarboxylate | C28H37NO8Si

2-Ethyl 1-methyl (1R,2S,3S)-1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-{(1Z)-3-oxo-3-[(triisopropylsilyl)oxy]-1-propen-1-yl}-1,2-cyclopropanedicarboxylate

  • Molecular FormulaC28H37NO8Si
  • Average mass543.681 Da
  • Monoisotopic mass543.228821 Da
  • ChemSpider ID74178648

  • 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

(1R,2S,3S)-1-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-{(1Z)-3-oxo-3-[(triisopropylsilyl)oxy]-1-propén-1-yl}-1,2-cyclopropanedicarboxylate de 2-éthyle et de 1-méthyle [French] [ACD/IUPAC Name]
1,2-Cyclopropanedicarboxylic acid, 1-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-3-[(1Z)-3-oxo-3-[[tris(1-methylethyl)silyl]oxy]-1-propen-1-yl]-, 2-ethyl 1-methyl ester, (1R,2S,3S)- [ACD/Index Name]
2-Ethyl 1-methyl (1R,2S,3S)-1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-{(1Z)-3-oxo-3-[(triisopropylsilyl)oxy]-1-propen-1-yl}-1,2-cyclopropanedicarboxylate [ACD/IUPAC Name]
2-Ethyl-1-methyl-(1R,2S,3S)-1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-{(1Z)-3-oxo-3-[(triisopropylsilyl)oxy]-1-propen-1-yl}-1,2-cyclopropandicarboxylat [German] [ACD/IUPAC 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: 578.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 303.7±30.1 °C
Index of Refraction: 1.560
Molar Refractivity: 143.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 7.24
ACD/LogD (pH 5.5): 6.62
ACD/BCF (pH 5.5): 63648.22
ACD/KOC (pH 5.5): 95528.10
ACD/LogD (pH 7.4): 6.62
ACD/BCF (pH 7.4): 63648.22
ACD/KOC (pH 7.4): 95528.10
Polar Surface Area: 116 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 444.4±3.0 cm3

Click to predict properties on the Chemicalize site


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