Methyl 2-Octynoate

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Properties Simple | Detailed

Formula C9H14O2
IUPAC Name methyl oct-2-ynoate
Molecular Mass 154.206 g·mol−1
Heat of Formation -228.8 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 212.9 Å 3
Surface Area 224.36 Å 2
HOMO Energy -10.89 ± 0.55 eV
LUMO Energy 3.05 ± eV
Point Group Symmetry C1
Synonyms
  • 2-octynoic acid, methyl ester
  • folione
  • methyl 2-octinate
  • methyl 2-octynate
  • methyl hept-1-yne-1-carboxylate
  • methyl heptine carbonate
  • methyl pentylacetylenecarboxylate
  • oct-2-ynoic acid methyl ester
  • vert de violette, artificial
CAS Number(s)
  • 53073-28-2
  • 111-12-6
InChIKey FRLZQXRXIKQFNS-UHFFFAOYSA-N
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