ChemSpider 2D Image | 4,4'-(2,2,3,4,5,5-~2~H_6_)-3,4-Hexanediyldiphenol | C18H16D6O2

4,4'-(2,2,3,4,5,5-2H6)-3,4-Hexanediyldiphenol

  • Molecular FormulaC18H16D6O2
  • Average mass276.403 Da
  • Monoisotopic mass276.199646 Da
  • ChemSpider ID24533836

  • Non-standard isotope - Non-standard isotope

More details:

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

4,4'-(2,2,3,4,5,5-2H6)-3,4-Hexandiyldiphenol [German] [ACD/IUPAC Name]
4,4'-(2,2,3,4,5,5-2H6)-3,4-Hexanediyldiphenol [ACD/IUPAC Name]
4,4'-(2,2,3,4,5,5-2H6)-3,4-Hexanediyldiphénol [French] [ACD/IUPAC Name]
4,4'-(2,2,3,4,5,5-2H6)Hexane-3,4-diyldiphenol
Phenol, 4,4'-[1,2-di(ethyl-1,1-d2)-1,2-ethanediyl-1,2-d2]bis- [ACD/Index Name]
Hexestrol-d6 (hexane-2,2,3,4,5,5-d6) (meso)

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

Density: 1.1±0.1 g/cm3
Boiling Point: 399.5±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 181.6±16.9 °C
Index of Refraction: 1.582
Molar Refractivity: 82.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1416.76
ACD/KOC (pH 5.5): 6270.32
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1411.16
ACD/KOC (pH 7.4): 6245.52
Polar Surface Area: 40 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 247.3±3.0 cm3

Click to predict properties on the Chemicalize site


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