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Search term: InChIKey=NPTIBOCVSPURCS-JLNKQSITSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoic acid | C24H38O2

(9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoic acid

  • Molecular FormulaC24H38O2
  • Average mass358.557 Da
  • Monoisotopic mass358.287170 Da
  • ChemSpider ID30776540

  • Double-bond stereo - Double-bond stereo

More details:

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

(9Z,12Z,15Z,18Z,21Z)-9,12,15,18,21-Tetracosapentaenoic acid [ACD/IUPAC Name]
(9Z,12Z,15Z,18Z,21Z)-9,12,15,18,21-Tetracosapentaensäure [German] [ACD/IUPAC Name]
(9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoic acid
68378-48-3 [RN]
9,12,15,18,21-Tetracosapentaenoic acid, (9Z,12Z,15Z,18Z,21Z)- [ACD/Index Name]
Acide (9Z,12Z,15Z,18Z,21Z)-9,12,15,18,21-tétracosapentaénoïque [French] [ACD/IUPAC Name]
(9Z,12Z,15Z,18Z,21Z)-tetracosa-9,12,15,18,21-pentaenoic acid
(9Z,12Z,15Z,18Z,21Z)-Tetracosapentaenate
(9Z,12Z,15Z,18Z,21Z)-tetracosapentaenoate
24:5 (n-3)
More...

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

  • Miscellaneous

    • Chemical Class:

      A very long-chain <locant>omega</locant><minus/>3 fatty acid that is tetracosanoic acid having five double bonds located at positions 9, 12, 15, 18 and 21 (the (9<stereo>Z</stereo>,12<stereo>Z</stereo >,15<stereo>Z</stereo>,18<stereo>Z</stereo>,21<stereo>Z</stereo>-isomer). ChEBI CHEBI:77360
      A very long-chain omega-3 fatty acid that is tetracosanoic acid having five double bonds located at positions 9, 12, 15, 18 and 21 (the (9Z,12Z,15Z,18Z,21Z-isomer). ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77360, CHEBI:77360

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

Density: 0.9±0.1 g/cm3
Boiling Point: 467.3±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 79.9±6.0 kJ/mol
Flash Point: 363.9±15.2 °C
Index of Refraction: 1.506
Molar Refractivity: 115.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 8.33
ACD/LogD (pH 5.5): 6.52
ACD/BCF (pH 5.5): 34397.79
ACD/KOC (pH 5.5): 36476.74
ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 7.4): 551.57
ACD/KOC (pH 7.4): 584.91
Polar Surface Area: 37 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 35.4±3.0 dyne/cm
Molar Volume: 387.4±3.0 cm3

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