ChemSpider 2D Image | (4S,5S,8R,9R,10S)-4-[4-(Benzyloxy)phenyl]-9,10-dihydroxy-8-(triisopropylsilyloxy)-1,6-dioxaspiro[4.5]decan-2-one | C30H42O7Si

(4S,5S,8R,9R,10S)-4-[4-(Benzyloxy)phenyl]-9,10-dihydroxy-8-(triisopropylsilyloxy)-1,6-dioxaspiro[4.5]decan-2-one

  • Molecular FormulaC30H42O7Si
  • Average mass542.736 Da
  • Monoisotopic mass542.269958 Da
  • ChemSpider ID24776186

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(4S,5S,8R,9R,10S)-4-[4-(Benzyloxy)phenyl]-9,10-dihydroxy-8-(triisopropylsilyloxy)-1,6-dioxaspiro[4.5]decan-2-one
(4S,5S,8R,9R,10S)-4-[4-(Benzyloxy)phenyl]-9,10-dihydroxy-8-[(triisopropylsilyl)oxy]-1,6-dioxaspiro[4.5]decan-2-on [German] [ACD/IUPAC Name]
(4S,5S,8R,9R,10S)-4-[4-(Benzyloxy)phenyl]-9,10-dihydroxy-8-[(triisopropylsilyl)oxy]-1,6-dioxaspiro[4.5]decan-2-one [ACD/IUPAC Name]
(4S,5S,8R,9R,10S)-4-[4-(Benzyloxy)phényl]-9,10-dihydroxy-8-[(triisopropylsilyl)oxy]-1,6-dioxaspiro[4.5]décan-2-one [French] [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: 653.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 348.9±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 149.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.67
ACD/LogD (pH 5.5): 5.69
ACD/BCF (pH 5.5): 12378.09
ACD/KOC (pH 5.5): 29587.61
ACD/LogD (pH 7.4): 5.69
ACD/BCF (pH 7.4): 12378.07
ACD/KOC (pH 7.4): 29587.54
Polar Surface Area: 94 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 46.3±5.0 dyne/cm
Molar Volume: 460.2±5.0 cm3

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