ChemSpider 2D Image | 2-Methyl-2-propanyl benzyl[(1E,3R,4R,5S)-5-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-4-formyl-1-phenyl-1-hexen-3-yl]carbamate | C31H45NO4Si

2-Methyl-2-propanyl benzyl[(1E,3R,4R,5S)-5-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-4-formyl-1-phenyl-1-hexen-3-yl]carbamate

  • Molecular FormulaC31H45NO4Si
  • Average mass523.779 Da
  • Monoisotopic mass523.311768 Da
  • ChemSpider ID29272798

  • 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

2-Methyl-2-propanyl benzyl[(1E,3R,4R,5S)-5-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-4-formyl-1-phenyl-1-hexen-3-yl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-benzyl[(1E,3R,4R,5S)-5-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-4-formyl-1-phenyl-1-hexen-3-yl]carbamat [German] [ACD/IUPAC Name]
Benzyl[(1E,3R,4R,5S)-5-{[diméthyl(2-méthyl-2-propanyl)silyl]oxy}-4-formyl-1-phényl-1-hexén-3-yl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[(1R,2R,3S)-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-formyl-1-[(E)-2-phenylethenyl]butyl]-N-(phenylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
(E)-(2R,3S)-2-((1'S)-1'-TERT-BUTYLDIMETHYLSILOXYETHYL)-3-(N-BENZYL-TERT-BUTYLOXYCABONYLAMINO)-5-PHENYL-4-PENTENAL

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

Density: 1.0±0.1 g/cm3
Boiling Point: 588.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 309.9±30.1 °C
Index of Refraction: 1.531
Molar Refractivity: 156.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 9.69
ACD/LogD (pH 5.5): 8.33
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 812811.50
ACD/LogD (pH 7.4): 8.33
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 812811.50
Polar Surface Area: 56 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 35.8±3.0 dyne/cm
Molar Volume: 506.6±3.0 cm3

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