ChemSpider 2D Image | (5Z,8Z,10E,12E,14R,15S)-14,15-Dihydroxy-5,8,10,12-icosatetraenoate | C20H31O4

(5Z,8Z,10E,12E,14R,15S)-14,15-Dihydroxy-5,8,10,12-icosatetraenoate

  • Molecular FormulaC20H31O4
  • Average mass335.458 Da
  • Monoisotopic mass335.222778 Da
  • ChemSpider ID58827295

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5Z,8Z,10E,12E,14R,15S)-14,15-Dihydroxy-5,8,10,12-icosatetraenoat [German] [ACD/IUPAC Name]
(5Z,8Z,10E,12E,14R,15S)-14,15-Dihydroxy-5,8,10,12-icosatetraenoate [ACD/IUPAC Name]
(5Z,8Z,10E,12E,14R,15S)-14,15-Dihydroxy-5,8,10,12-icosatétraénoate [French] [ACD/IUPAC Name]
5,8,10,12-Eicosatetraenoic acid, 14,15-dihydroxy-, ion(1-), (5Z,8Z,10E,12E,14R,15S)- [ACD/Index Name]
(14R,15S)-DiHETE
(14R,15S)-dihydroxy-(5Z,8Z,10E,12E)-eicosatetraenoate
(14R,15S)-dihydroxy-(5Z,8Z,10E,12E)-icosatetraenoate
(5Z,8Z,10E,12E,14R,15S)-14,15-dihydroxyeicosatetraenoate
(5Z,8Z,10E,12E,14R,15S)-14,15-dihydroxyicosa-5,8,10,12-tetraenoate
(5Z,8Z,10E,12E,14R,15S)-14,15-dihydroxyicosatetraenoate
More...
  • Miscellaneous

    • Chemical Class:

      A DiHETE(1-) that is the conjugate base of 14(R),15(S)-DiHETE arising from deprotonation of the carboxylic acid function; major species at pH 7.3. ChEBI CHEBI:133916

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

Density:
Boiling Point: 537.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.7±6.0 kJ/mol
Flash Point: 293.0±26.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 180.60
ACD/KOC (pH 5.5): 838.35
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 2.88
ACD/KOC (pH 7.4): 13.37
Polar Surface Area: 81 Å2
Polarizability:
Surface Tension:
Molar Volume:

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