ChemSpider 2D Image | 2-Hydroxy-1,3-propanediyl (11Z,14Z,17Z,11'Z,14'Z,17'Z)bis(-11,14,17-icosatrienoate) | C43H72O5

2-Hydroxy-1,3-propanediyl (11Z,14Z,17Z,11'Z,14'Z,17'Z)bis(-11,14,17-icosatrienoate)

  • Molecular FormulaC43H72O5
  • Average mass669.029 Da
  • Monoisotopic mass668.537964 Da
  • ChemSpider ID58191552

  • Double-bond stereo - Double-bond stereo

More details:

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

(11Z,14Z,17Z,11'Z,14'Z,17'Z)Bis(-11,14,17-icosatriénoate) de 2-hydroxy-1,3-propanediyle [French] [ACD/IUPAC Name]
11,14,17-Eicosatrienoic acid, 2-hydroxy-1,3-propanediyl ester, (11Z,14Z,17Z,11'Z,14'Z,17'Z)- [ACD/Index Name]
2-Hydroxy-1,3-propandiyl-(11Z,14Z,17Z,11'Z,14'Z,17'Z)bis(-11,14,17-icosatrienoat) [German] [ACD/IUPAC Name]
2-Hydroxy-1,3-propanediyl (11Z,14Z,17Z,11'Z,14'Z,17'Z)bis(-11,14,17-icosatrienoate) [ACD/IUPAC Name]
960594-33-6 [RN]
(11Z,11'Z,14Z,14'Z,17Z,17'Z)-11,14,17-eicosatrienoic acid, 1,1'-(2-hydroxy-1,3-propanediyl) ester
1,3-dieicosatrienoin

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

Density: 0.9±0.1 g/cm3
Boiling Point: 714.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.3±6.0 kJ/mol
Flash Point: 196.8±25.0 °C
Index of Refraction: 1.498
Molar Refractivity: 206.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 15.16
ACD/LogD (pH 5.5): 11.98
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.98
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 81.9±0.5 10-24cm3
Surface Tension: 36.3±3.0 dyne/cm
Molar Volume: 704.9±3.0 cm3

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