4-Methylpentanoyl (3R)-3-Methylhexanoate

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Properties Simple | Detailed

Formula C13H24O3
IUPAC Name 4-methylpentanoyl (3r)-3-methylhexanoate
Molecular Mass 228.328 g·mol−1
Heat of Formation -778.3 ± 16.7 kJ·mol−1
Dipole Moment 3.82 ± 1.08 D
Volume 317.58 Å 3
Surface Area 301.54 Å 2
HOMO Energy -10.59 ± 0.55 eV
LUMO Energy 3.60 ± eV
Point Group Symmetry C1
InChIKey XJQSKQRAFRCKJE-LLVKDONJSA-N
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Elements H C O