ChemSpider 2D Image | (6E,10Z,13Z,16Z,19Z)-4-Oxo-6,10,13,16,19-docosapentaenoic acid | C22H32O3

(6E,10Z,13Z,16Z,19Z)-4-Oxo-6,10,13,16,19-docosapentaenoic acid

  • Molecular FormulaC22H32O3
  • Average mass344.488 Da
  • Monoisotopic mass344.235138 Da
  • ChemSpider ID25060225

  • Double-bond stereo - Double-bond stereo

More details:

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

(6E,10Z,13Z,16Z,19Z)-4-Oxo-6,10,13,16,19-docosapentaenoic acid [ACD/IUPAC Name]
(6E,10Z,13Z,16Z,19Z)-4-Oxo-6,10,13,16,19-docosapentaensäure [German] [ACD/IUPAC Name]
(6e,10z,13z,16z,19z)-4-Oxodocosa-6,10,13,16,19-Pentaenoic Acid
6,10,13,16,19-Docosapentaenoic acid, 4-oxo-, (6E,10Z,13Z,16Z,19Z)- [ACD/Index Name]
Acide (6E,10Z,13Z,16Z,19Z)-4-oxo-6,10,13,16,19-docosapentaénoïque [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 507.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 85.1±6.0 kJ/mol
Flash Point: 274.8±26.6 °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: 5.85
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 843.52
ACD/KOC (pH 5.5): 2424.88
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 13.32
ACD/KOC (pH 7.4): 38.29
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

Click to predict properties on the Chemicalize site


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