ChemSpider 2D Image | [(~2~H_4_)-2-Pyridinyl(~2~H)methylene]di(~2~H_4_)-4,1-phenylene diacetate | C22H6D13NO4

[(2H4)-2-Pyridinyl(2H)methylene]di(2H4)-4,1-phenylene diacetate

  • Molecular FormulaC22H6D13NO4
  • Average mass374.471 Da
  • Monoisotopic mass374.213013 Da
  • ChemSpider ID48059196

  • Non-standard isotope - Non-standard isotope

More details:

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

[(2H4)-2-Pyridinyl(2H)methylen]di(2H4)-4,1-phenylen-diacetat [German] [ACD/IUPAC Name]
[(2H4)-2-Pyridinyl(2H)methylene]di(2H4)-4,1-phenylene diacetate [ACD/IUPAC Name]
Diacétate de [(2H4)-2-pyridinyl(2H)méthylène]di(2H4)-4,1-phénylène [French] [ACD/IUPAC Name]
Phenol-d4, 4,4'-(2-pyridinyl-d4-methylene-d)bis-, diacetate (ester) [ACD/Index Name]
[4-[(4-acetyloxy-2,3,5,6-tetradeuteriophenyl)-deuterio-(3,4,5,6-tetradeuteriopyridin-2-yl)methyl]-2,3,5,6-tetradeuteriophenyl] acetate
1276427-51-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 492.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 251.6±28.7 °C
Index of Refraction: 1.584
Molar Refractivity: 100.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 236.72
ACD/KOC (pH 5.5): 1671.99
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 273.01
ACD/KOC (pH 7.4): 1928.31
Polar Surface Area: 65 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 301.2±3.0 cm3

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