12S-Hhtre

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Properties Simple | Detailed

Formula C17H28O3
IUPAC Name (5z,8e,10e,12s)-12-hydroxyheptadeca-5,8,10-trienoic acid
Molecular Mass 280.402 g·mol−1
Heat of Formation -638.0 ± 16.7 kJ·mol−1
Dipole Moment 1.83 ± 1.08 D
Volume 399.0 Å 3
Surface Area 335.02 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (5z,8e,10e,12s)-12-hydroxyheptadeca-5,8,10-trienoic acid
  • 12(s)-hht
  • 12(s)-hydroxy-(5z,8e,10e)-heptadecatrienoic acid
  • 12s-hydroxy-5z,8e,10e-heptadecatrienoic acid
  • lmfa03050002
InChIKey KUKJHGXXZWHSBG-WBGSEQOASA-N
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