(5E,8E,10Z)-12-Oxo-5,8,10-Heptadecatrienoic Acid

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Properties Simple | Detailed

Formula C17H26O3
IUPAC Name (5e,8e,10z)-12-oxoheptadeca-5,8,10-trienoic acid
Molecular Mass 278.387 g·mol−1
Heat of Formation -588.7 ± 16.7 kJ·mol−1
Dipole Moment 3.54 ± 1.08 D
Volume 388.9 Å 3
Surface Area 309.23 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (5e,8e,10z)-12-ketoheptadeca-5,8,10-trienoic acid
  • (5e,8e,10z)-12-oxoheptadeca-5,8,10-trienoic acid
  • 12-keto-5,8,10-heptadecatrienoic acid
  • 12-keto-hdta
  • 12-oxo-5e,8e,10z-heptadecatrienoic acid
  • 5,8,10-heptadecatrienoic acid, 12-oxo-, (e,e,z)-
CAS Number(s)
  • 103374-38-5
InChIKey BEHRKNVAYQNKGG-XTYDYNBASA-N
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