ChemSpider 2D Image | (3a'S,5'S,6'R,6a'S)-5'-[(2S)-1,4-Dioxaspiro[4.5]dec-2-yl]-6'-methoxytetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] (non-preferred name) | C19H30O6

(3a'S,5'S,6'R,6a'S)-5'-[(2S)-1,4-Dioxaspiro[4.5]dec-2-yl]-6'-methoxytetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] (non-preferred name)

  • Molecular FormulaC19H30O6
  • Average mass354.438 Da
  • Monoisotopic mass354.204254 Da
  • ChemSpider ID78427951

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(3a'S,5'S,6'R,6a'S)-5'-[(2S)-1,4-Dioxaspiro[4.5]dec-2-yl]-6'-methoxytetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole] (non-preferred name) [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: 465.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 189.4±28.6 °C
Index of Refraction: 1.539
Molar Refractivity: 90.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 543.85
ACD/KOC (pH 5.5): 3159.80
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 543.85
ACD/KOC (pH 7.4): 3159.80
Polar Surface Area: 55 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 287.8±5.0 cm3

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