ChemSpider 2D Image | 1,3-Dihydroxy(~2~H_5_)-2-propanyl (5E,8E,11E,14E)-5,8,11,14-icosatetraenoate | C23H33D5O4

1,3-Dihydroxy(2H5)-2-propanyl (5E,8E,11E,14E)-5,8,11,14-icosatetraenoate

  • Molecular FormulaC23H33D5O4
  • Average mass383.576 Da
  • Monoisotopic mass383.308380 Da
  • ChemSpider ID62854221
  • 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

(5E,8E,11E,14E)-5,8,11,14-Icosatétraénoate de 1,3-dihydroxy(2H5)-2-propanyle [French] [ACD/IUPAC Name]
1,3-Dihydroxy(2H5)-2-propanyl (5E,8E,11E,14E)-5,8,11,14-icosatetraenoate [ACD/IUPAC Name]
1,3-Dihydroxy(2H5)-2-propanyl-(5E,8E,11E,14E)-5,8,11,14-icosatetraenoat [German] [ACD/IUPAC Name]
5,8,11,14-Eicosatetraenoic acid, 2-hydroxy-1-(hydroxymethyl-d2)ethyl-1,2,2-d3 ester, (5E,8E,11E,14E)- [ACD/Index Name]
1215168-37-8 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 508.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 89.7±6.0 kJ/mol
Flash Point: 163.0±23.6 °C
Index of Refraction: 1.508
Molar Refractivity: 113.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 6.24
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15795.92
ACD/KOC (pH 5.5): 35229.42
ACD/LogD (pH 7.4): 5.83
ACD/BCF (pH 7.4): 15795.90
ACD/KOC (pH 7.4): 35229.38
Polar Surface Area: 67 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 381.5±3.0 cm3

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