ChemSpider 2D Image | Tetramethyl (1R,3S,5r,7s)-2,6-dioxo-1,3,5,7-adamantanetetracarboxylate | C18H20O10

Tetramethyl (1R,3S,5r,7s)-2,6-dioxo-1,3,5,7-adamantanetetracarboxylate

  • Molecular FormulaC18H20O10
  • Average mass396.345 Da
  • Monoisotopic mass396.105652 Da
  • ChemSpider ID34452233

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,3S,5r,7s)-2,6-Dioxo-1,3,5,7-adamantanetétracarboxylate de tétraméthyle [French] [ACD/IUPAC Name]
Tetramethyl (1R,3S,5r,7s)-2,6-dioxo-1,3,5,7-adamantanetetracarboxylate [ACD/IUPAC Name]
Tetramethyl-(1R,3S,5r,7s)-2,6-dioxo-1,3,5,7-adamantantetracarboxylat [German] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1,3,5,7-tetracarboxylic acid, 2,6-dioxo-, tetramethyl ester [ACD/Index Name]
(1r,3r,5r,7r)-Tetramethyl 2,6-dioxoadamantane-1,3,5,7-tetracarboxylate
53120-57-3 [RN]
MFCD01825572

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

Density: 1.5±0.1 g/cm3
Boiling Point: 502.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 220.2±30.2 °C
Index of Refraction: 1.570
Molar Refractivity: 85.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 9.21
ACD/KOC (pH 5.5): 170.52
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 9.21
ACD/KOC (pH 7.4): 170.52
Polar Surface Area: 139 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 261.9±3.0 cm3

Click to predict properties on the Chemicalize site


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