Found 4 results

Search term: MF = 'C_{26}H_{41}BrO_{6}Si'
ChemSpider 2D Image | [(1S,2R,6S)-2-(Benzyloxy)-4-bromo-5,5-dimethoxy-3-{[(triisopropylsilyl)oxy]methyl}-7-oxabicyclo[4.1.0]hept-3-en-1-yl]methanol | C26H41BrO6Si

[(1S,2R,6S)-2-(Benzyloxy)-4-bromo-5,5-dimethoxy-3-{[(triisopropylsilyl)oxy]methyl}-7-oxabicyclo[4.1.0]hept-3-en-1-yl]methanol

  • Molecular FormulaC26H41BrO6Si
  • Average mass557.590 Da
  • Monoisotopic mass556.185547 Da
  • ChemSpider ID26571932

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

[(1S,2R,6S)-2-(Benzyloxy)-4-brom-5,5-dimethoxy-3-{[(triisopropylsilyl)oxy]methyl}-7-oxabicyclo[4.1.0]hept-3-en-1-yl]methanol [German] [ACD/IUPAC Name]
[(1S,2R,6S)-2-(Benzyloxy)-4-bromo-5,5-dimethoxy-3-{[(triisopropylsilyl)oxy]methyl}-7-oxabicyclo[4.1.0]hept-3-en-1-yl]methanol [ACD/IUPAC Name]
[(1S,2R,6S)-2-(Benzyloxy)-4-bromo-5,5-diméthoxy-3-{[(triisopropylsilyl)oxy]méthyl}-7-oxabicyclo[4.1.0]hept-3-én-1-yl]méthanol [French] [ACD/IUPAC Name]
7-Oxabicyclo[4.1.0]hept-3-ene-1-methanol, 4-bromo-5,5-dimethoxy-2-(phenylmethoxy)-3-[[[tris(1-methylethyl)silyl]oxy]methyl]-, (1S,2R,6S)- [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: 549.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 286.2±30.1 °C
Index of Refraction: 1.538
Molar Refractivity: 141.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 9.10
ACD/LogD (pH 5.5): 7.64
ACD/BCF (pH 5.5): 377298.81
ACD/KOC (pH 5.5): 341479.22
ACD/LogD (pH 7.4): 7.64
ACD/BCF (pH 7.4): 377298.81
ACD/KOC (pH 7.4): 341479.22
Polar Surface Area: 70 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 40.6±5.0 dyne/cm
Molar Volume: 451.8±5.0 cm3

Click to predict properties on the Chemicalize site


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