ChemSpider 2D Image | 2,2',2''-[Benzene-1,3,5-triyltris(2,1-ethanediyloxy-2,1-ethanediyloxy)]tris(tetrahydro-2H-pyran) | C33H54O9

2,2',2''-[Benzene-1,3,5-triyltris(2,1-ethanediyloxy-2,1-ethanediyloxy)]tris(tetrahydro-2H-pyran)

  • Molecular FormulaC33H54O9
  • Average mass594.776 Da
  • Monoisotopic mass594.376770 Da
  • ChemSpider ID8754763

More details:

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

2,2',2''-[Benzene-1,3,5-triyltris(2,1-ethanediyloxy-2,1-ethanediyloxy)]tris(tetrahydro-2H-pyran) [ACD/IUPAC Name]
2,2',2''-[Benzène-1,3,5-triyltris(2,1-éthanediyloxy-2,1-éthanediyloxy)]tris(tétrahydro-2H-pyrane) [French] [ACD/IUPAC Name]
2,2',2''-[Benzol-1,3,5-triyltris(2,1-ethandiyloxy-2,1-ethandiyloxy)]tris(tetrahydro-2H-pyran) [German] [ACD/IUPAC Name]
2H-Pyran, 2,2',2''-[benzene-1,3,5-triyltris(2,1-ethanediyloxy-2,1-ethanediyloxy)]tris[tetrahydro- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 677.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 250.3±31.4 °C
Index of Refraction: 1.523
Molar Refractivity: 161.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 1
ACD/LogP: 2.15
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 226.00
ACD/KOC (pH 5.5): 1685.30
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 226.00
ACD/KOC (pH 7.4): 1685.30
Polar Surface Area: 83 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 527.7±5.0 cm3

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