Found 3 results

Search term: QIKGPDYILNCGHY (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 6,8,9-Tris(benzyloxy)-2,4,10-trioxatricyclo[3.3.1.1~3,7~]decane | C28H28O6

6,8,9-Tris(benzyloxy)-2,4,10-trioxatricyclo[3.3.1.13,7]decane

  • Molecular FormulaC28H28O6
  • Average mass460.518 Da
  • Monoisotopic mass460.188599 Da
  • ChemSpider ID24604457

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

2,4,10-Trioxatricyclo[3.3.1.13,7]decane, 6,8,9-tris(phenylmethoxy)- [ACD/Index Name]
6,8,9-Tris(benzyloxy)-2,4,10-trioxatricyclo[3.3.1.13,7]decan [German] [ACD/IUPAC Name]
6,8,9-Tris(benzyloxy)-2,4,10-trioxatricyclo[3.3.1.13,7]decane [ACD/IUPAC Name]
6,8,9-Tris(benzyloxy)-2,4,10-trioxatricyclo[3.3.1.13,7]décane [French] [ACD/IUPAC Name]
(1R,3R,5R,6R,7S,8R,9S)-6,8,9-Tris(benzyloxy)-2,4,10-trioxaadamantane

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

Density: 1.3±0.1 g/cm3
Boiling Point: 573.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 227.2±30.0 °C
Index of Refraction: 1.629
Molar Refractivity: 126.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 9.91
ACD/LogD (pH 5.5): 6.47
ACD/BCF (pH 5.5): 48555.59
ACD/KOC (pH 5.5): 78703.18
ACD/LogD (pH 7.4): 6.47
ACD/BCF (pH 7.4): 48555.59
ACD/KOC (pH 7.4): 78703.18
Polar Surface Area: 55 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 55.1±5.0 dyne/cm
Molar Volume: 356.5±5.0 cm3

Click to predict properties on the Chemicalize site


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