ChemSpider 2D Image | 4,4'-(2E,4E)-(2,5-~2~H_2_)-2,4-Hexadiene-3,4-diyldi(2,6-~2~H_2_)phenol | C18H12D6O2

4,4'-(2E,4E)-(2,5-2H2)-2,4-Hexadiene-3,4-diyldi(2,6-2H2)phenol

  • Molecular FormulaC18H12D6O2
  • Average mass272.371 Da
  • Monoisotopic mass272.168335 Da
  • ChemSpider ID77450849

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

4,4'-(2E,4E)-(2,5-2H2)-2,4-Hexadien-3,4-diyldi(2,6-2H2)phenol [German] [ACD/IUPAC Name]
4,4'-(2E,4E)-(2,5-2H2)-2,4-Hexadiene-3,4-diyldi(2,6-2H2)phenol [ACD/IUPAC Name]
4,4'-(2E,4E)-(2,5-2H2)-2,4-Hexadiène-3,4-diyldi(2,6-2H2)phénol [French] [ACD/IUPAC Name]
Phenol-2,6-d2, 4,4'-[(1E,2E)-1,2-di(ethylidene-1-d)-1,2-ethanediyl]bis- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 395.4±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 181.4±16.9 °C
Index of Refraction: 1.624
Molar Refractivity: 83.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1537.38
ACD/KOC (pH 5.5): 6648.05
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1534.85
ACD/KOC (pH 7.4): 6637.10
Polar Surface Area: 40 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 235.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement