Heptyl Caprylate

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Properties Simple | Detailed

Formula C15H30O2
IUPAC Name heptyl octanoate
Molecular Mass 242.397 g·mol−1
Heat of Formation -687.9 ± 16.7 kJ·mol−1
Dipole Moment 2.13 ± 1.08 D
Volume 359.8 Å 3
Surface Area 300.14 Å 2
HOMO Energy -10.60 ± 0.55 eV
LUMO Energy 4.20 ± eV
Point Group Symmetry C1
Synonyms
  • caprylic acid heptyl ester
  • heptyl octylate
  • octanoic acid heptyl ester
  • octanoic acid, heptyl ester
CAS Number(s)
  • 4265-97-8
InChIKey TZXWLJYLYILFGM-UHFFFAOYSA-N
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Elements H C O