ChemSpider 2D Image | (7Z,10Z,14E,16Z,19Z)-13-Oxo-7,10,14,16,19-docosapentaenoic acid | C22H32O3

(7Z,10Z,14E,16Z,19Z)-13-Oxo-7,10,14,16,19-docosapentaenoic acid

  • Molecular FormulaC22H32O3
  • Average mass344.488 Da
  • Monoisotopic mass344.235138 Da
  • ChemSpider ID24603888
  • Double-bond stereo - Double-bond stereo


More details:






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

(7Z,10Z,14E,16Z,19Z)-13-Oxo-7,10,14,16,19-docosapentaenoic acid [ACD/IUPAC Name]
(7Z,10Z,14E,16Z,19Z)-13-Oxo-7,10,14,16,19-docosapentaensäure [German] [ACD/IUPAC Name]
7,10,14,16,19-Docosapentaenoic acid, 13-oxo-, (7Z,10Z,14E,16Z,19Z)- [ACD/Index Name]
Acide (7Z,10Z,14E,16Z,19Z)-13-oxo-7,10,14,16,19-docosapentaénoïque [French] [ACD/IUPAC Name]
(7Z,10Z,14E,16Z,19Z)-13-oxodocosa-7,10,14,16,19-pentaenoic acid
(7Z,10Z,14E,16Z,19Z)-13-Oxodocosapentaenoic acid

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

Density: 1.0±0.1 g/cm3
Boiling Point: 495.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 83.5±6.0 kJ/mol
Flash Point: 267.3±25.2 °C
Index of Refraction: 1.514
Molar Refractivity: 105.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 5.76
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 1389.46
ACD/KOC (pH 5.5): 3642.26
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 22.22
ACD/KOC (pH 7.4): 58.26
Polar Surface Area: 54 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 351.5±3.0 cm3

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