4-Methylpentyl Cyclohexanecarboxylate

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Properties Simple | Detailed

Formula C13H24O2
IUPAC Name isohexyl cyclohexanecarboxylate
Molecular Mass 212.328 g·mol−1
Heat of Formation -584.9 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 296.17 Å 3
Surface Area 279.8 Å 2
HOMO Energy -10.47 ± 0.55 eV
LUMO Energy 0.92 ± eV
Point Group Symmetry C1
Synonyms
  • cyclohexanecarboxylic acid isohexyl ester
  • cyclohexanecarboxylic acid, 4-methylpentyl ester
InChIKey YAIBBTZCDWTLFC-UHFFFAOYSA-N
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Elements H C O