ChemSpider 2D Image | (4R,5S,8R,9S)-8-[(1R)-1,2-Dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione | C15H16O8

(4R,5S,8R,9S)-8-[(1R)-1,2-Dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione

  • Molecular FormulaC15H16O8
  • Average mass324.283 Da
  • Monoisotopic mass324.084503 Da
  • ChemSpider ID66000344

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(4R,5S,8R,9S)-8-[(1R)-1,2-Dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-1,7-dioxaspiro[4.4]nonan-2,6-dion [German] [ACD/IUPAC Name]
(4R,5S,8R,9S)-8-[(1R)-1,2-Dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-1,7-dioxaspiro[4.4]nonane-2,6-dione [ACD/IUPAC Name]
(4R,5S,8R,9S)-8-[(1R)-1,2-Dihydroxyéthyl]-9-hydroxy-4-(4-hydroxyphényl)-1,7-dioxaspiro[4.4]nonane-2,6-dione [French] [ACD/IUPAC Name]
1,7-Dioxaspiro[4.4]nonane-2,6-dione, 8-[(1R)-1,2-dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-, (4R,5S,8R,9S)- [ACD/Index Name]
Leucodrin

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

Density: 1.6±0.1 g/cm3
Boiling Point: 747.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 282.7±26.4 °C
Index of Refraction: 1.669
Molar Refractivity: 74.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.74
ACD/LogD (pH 5.5): -1.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.98
ACD/LogD (pH 7.4): -1.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.97
Polar Surface Area: 134 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 89.3±5.0 dyne/cm
Molar Volume: 198.7±5.0 cm3

Click to predict properties on the Chemicalize site


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