(3R)-2,2,4-Trimethyl-1,3-Pentanediyl Bis(2-Methylpropanoate)

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Properties Simple | Detailed

Formula C16H30O4
IUPAC Name [(3r)-2,2,4-trimethyl-3-(2-methylpropanoyloxy)pentyl] 2-methylpropanoate
Molecular Mass 286.407 g·mol−1
Heat of Formation -1027.4 ± 16.7 kJ·mol−1
Dipole Moment 1.58 ± 1.08 D
Volume 396.53 Å 3
Surface Area 310.69 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy 4.28 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methylpropanoic acid [(1r)-1-isopropyl-2,2-dimethyl-3-(2-methyl-1-oxopropoxy)propyl] ester
  • 2-methylpropionic acid [(1r)-3-isobutyryloxy-1-isopropyl-2,2-dimethyl-propyl] ester
  • [(1r)-1-isopropyl-2,2-dimethyl-3-(2-methylpropanoyloxy)propyl] 2-methylpropanoate
  • [(3r)-2,2,4-trimethyl-1-(2-methylpropanoyloxy)pentan-3-yl] 2-methylpropanoate
InChIKey OMVSWZDEEGIJJI-CYBMUJFWSA-N
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Elements H C O