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Search term: InChIKey=VQHJSIBYSWTMLS-NEUKSRIFSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | Methyl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoate | C23H36O2

Methyl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoate

  • Molecular FormulaC23H36O2
  • Average mass344.531 Da
  • Monoisotopic mass344.271515 Da
  • ChemSpider ID29756763

  • Double-bond stereo - Double-bond stereo

More details:

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

(4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-Docosapentaénoate de méthyle [French] [ACD/IUPAC Name]
31930-67-3 [RN]
4,7,10,13,16-Docosapentaenoic acid, methyl ester, (4Z,7Z,10Z,13Z,16Z)- [ACD/Index Name]
Methyl (4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoate [ACD/IUPAC Name]
Methyl-(4Z,7Z,10Z,13Z,16Z)-4,7,10,13,16-docosapentaenoat [German] [ACD/IUPAC Name]
(4Z,7Z,10Z,13Z,16Z) 4,7,10,13,16-Docosapentaenoic Acid Methyl Ester
4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid, methyl ester
all-cis-4,7,10,13,16-Docosapentaenoic Acid methyl ester
C225
Methyl 4,7,10,13,16-docosapentaenoate

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

Density: 0.9±0.1 g/cm3
Boiling Point: 431.0±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.7±3.0 kJ/mol
Flash Point: 101.5±21.2 °C
Index of Refraction: 1.495
Molar Refractivity: 110.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 7.92
ACD/LogD (pH 5.5): 7.41
ACD/BCF (pH 5.5): 251331.88
ACD/KOC (pH 5.5): 255312.50
ACD/LogD (pH 7.4): 7.41
ACD/BCF (pH 7.4): 251331.88
ACD/KOC (pH 7.4): 255312.50
Polar Surface Area: 26 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 32.7±3.0 dyne/cm
Molar Volume: 379.7±3.0 cm3

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