Octyl 6-Aminohexanoate

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Properties Simple | Detailed

Formula C14H29NO2
IUPAC Name octyl 6-aminohexanoate
Molecular Mass 243.386 g·mol−1
Heat of Formation -629.7 ± 16.7 kJ·mol−1
Dipole Moment 2.03 ± 1.08 D
Volume 354.89 Å 3
Surface Area 296.13 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 1.14 ± eV
Point Group Symmetry C1
Synonyms
  • 6-aminohexanoic acid octyl ester
  • epsilon-aminocaproic acid 1-octyl ester
  • hexanoic acid, 6-amino-, octyl ester, hydrochloride
  • oceac
  • octyl 6-aminocaproate
  • octyl epsilon-aminocaproate
CAS Number(s)
  • 16625-94-8
  • 75980-37-9
InChIKey RWQXXPMKLWJWEU-UHFFFAOYSA-N
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