ChemSpider 2D Image | (8aR)-8a-Hydroxy-3,3,6,6,8,8-hexamethyl-8,8a-dihydro-1,2-benzodioxine-5,7(3H,6H)-dione | C14H20O5

(8aR)-8a-Hydroxy-3,3,6,6,8,8-hexamethyl-8,8a-dihydro-1,2-benzodioxine-5,7(3H,6H)-dione

  • Molecular FormulaC14H20O5
  • Average mass268.306 Da
  • Monoisotopic mass268.131073 Da
  • ChemSpider ID23129550

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(8aR)-8a-Hydroxy-3,3,6,6,8,8-hexamethyl-8,8a-dihydro-1,2-benzodioxin-5,7(3H,6H)-dion [German] [ACD/IUPAC Name]
(8aR)-8a-Hydroxy-3,3,6,6,8,8-hexamethyl-8,8a-dihydro-1,2-benzodioxine-5,7(3H,6H)-dione [ACD/IUPAC Name]
(8aR)-8a-Hydroxy-3,3,6,6,8,8-hexaméthyl-8,8a-dihydro-1,2-benzodioxine-5,7(3H,6H)-dione [French] [ACD/IUPAC Name]
1,2-Benzodioxin-5,7(3H,6H)-dione, 8,8a-dihydro-8a-hydroxy-3,3,6,6,8,8-hexamethyl-, (8aR)- [ACD/Index Name]
(R)-8a-Hydroxy-3,3,6,6,8,8-hexamethyl-8,8a-dihydro-3H-benzo[c][1,2]dioxine-5,7-dione

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

Density: 1.2±0.1 g/cm3
Boiling Point: 379.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.6±6.0 kJ/mol
Flash Point: 137.1±21.4 °C
Index of Refraction: 1.526
Molar Refractivity: 67.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 14.31
ACD/KOC (pH 5.5): 233.79
ACD/LogD (pH 7.4): 1.82
ACD/BCF (pH 7.4): 14.30
ACD/KOC (pH 7.4): 233.68
Polar Surface Area: 73 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 44.0±5.0 dyne/cm
Molar Volume: 220.9±5.0 cm3

Click to predict properties on the Chemicalize site


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