ChemSpider 2D Image | (21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid | C36H64O2

(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid

  • Molecular FormulaC36H64O2
  • Average mass528.892 Da
  • Monoisotopic mass528.490601 Da
  • ChemSpider ID30786334

  • Double-bond stereo - Double-bond stereo

More details:

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

(21Z,24Z,27Z,30Z)-21,24,27,30-Hexatriacontatetraenoic acid [ACD/IUPAC Name]
(21Z,24Z,27Z,30Z)-21,24,27,30-Hexatriacontatetraensäure [German] [ACD/IUPAC Name]
(21Z,24Z,27Z,30Z)-hexatriacontatetraenoic acid
21,24,27,30-Hexatriacontatetraenoic acid, (21Z,24Z,27Z,30Z)- [ACD/Index Name]
Acide (21Z,24Z,27Z,30Z)-21,24,27,30-hexatriacontatétraénoïque [French] [ACD/IUPAC Name]
(21Z,24Z,27Z,30Z)-hexatriaconta-21,24,27,30-tetraenoic acid
21Z,24Z,27Z,30Z-hexatriacontatetraenoic acid
36:4(21Z,24Z,27Z,30Z)
36:4(w6)
36:4(ω6)
More...
  • Miscellaneous

    • Chemical Class:

      A very long-chain <locant>omega</locant><minus/>6 fatty acid that is hexatriacontanoic acid having four double bonds located at positions 21, 24, 27 and 30 (the 21<stereo>Z</stereo>,24<stereo>Z</stere o>,27<stereo>Z</stereo>,30<stereo>Z</stereo>-isomer). ChEBI CHEBI:77538
      An omega-6 fatty acid that is hexatriacontanoic acid having four double bonds located at positions 21, 24, 27 and 30 (the 21Z,24Z,27<stereo>Z<; /stereo>,30Z-isomer). ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77538
      An omega-6 fatty acid that is hexatriacontanoic acid having four double bonds located at positions 21, 24, 27 and 30 (the 21Z,24Z,27Z,30Z-isomer). ChEBI CHEBI:77538

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

Density: 0.9±0.1 g/cm3
Boiling Point: 624.5±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 100.9±6.0 kJ/mol
Flash Point: 520.6±18.0 °C
Index of Refraction: 1.488
Molar Refractivity: 170.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 2
ACD/LogP: 15.38
ACD/LogD (pH 5.5): 11.84
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.04
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 454964.56
Polar Surface Area: 37 Å2
Polarizability: 67.6±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 591.9±3.0 cm3

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