9,12-Octadecadiynoic Acid

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Properties Simple | Detailed

Formula C18H28O2
IUPAC Name octadeca-9,12-diynoic acid
Molecular Mass 276.414 g·mol−1
Heat of Formation -230.2 ± 16.7 kJ·mol−1
Dipole Moment 2.05 ± 1.08 D
Volume 398.82 Å 3
Surface Area 338.36 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 1.00 ± eV
Point Group Symmetry C1
Synonyms
  • 9a-12a-octadecadiynoic acid
  • lmfa01030540
  • ro 3-1314
  • ro-3-1314
CAS Number(s)
  • 2012-14-8
InChIKey KDYILQLPKVZDGB-UHFFFAOYSA-N
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Elements H C O