ChemSpider 2D Image | 1,3-Dihydroxy-2-propanyl (7Z,10Z,13Z,16Z,19Z)-7,10,13,16,19-docosapentaenoate | C25H40O4

1,3-Dihydroxy-2-propanyl (7Z,10Z,13Z,16Z,19Z)-7,10,13,16,19-docosapentaenoate

  • Molecular FormulaC25H40O4
  • Average mass404.583 Da
  • Monoisotopic mass404.292664 Da
  • ChemSpider ID24765780
  • Double-bond stereo - Double-bond stereo


More details:






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

(7Z,10Z,13Z,16Z,19Z)-7,10,13,16,19-Docosapentaénoate de 1,3-dihydroxy-2-propanyle [French] [ACD/IUPAC Name]
1,3-Dihydroxy-2-propanyl (7Z,10Z,13Z,16Z,19Z)-7,10,13,16,19-docosapentaenoate [ACD/IUPAC Name]
1,3-Dihydroxy-2-propanyl-(7Z,10Z,13Z,16Z,19Z)-7,10,13,16,19-docosapentaenoat [German] [ACD/IUPAC Name]
7,10,13,16,19-Docosapentaenoic acid, 2-hydroxy-1-(hydroxymethyl)ethyl ester, (7Z,10Z,13Z,16Z,19Z)- [ACD/Index Name]
1,3-dihydroxypropan-2-yl (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate
1-Monoacylglyceride
1-Monoacylglycerol
2-(22:5(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycerol
2-(7Z,10Z,13Z,16Z,19Z-Docosapentaenoyl)-rac-glycerol
2-Docosapentaenoyl-glycerol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.0±0.1 g/cm3
Boiling Point: 531.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.9±6.0 kJ/mol
Flash Point: 167.8±23.6 °C
Index of Refraction: 1.514
Molar Refractivity: 123.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 5.82
ACD/BCF (pH 5.5): 15539.03
ACD/KOC (pH 5.5): 34818.38
ACD/LogD (pH 7.4): 5.82
ACD/BCF (pH 7.4): 15539.01
ACD/KOC (pH 7.4): 34818.34
Polar Surface Area: 67 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 408.1±3.0 cm3

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