Isohexyl 4,4-Dimethylpentanoate

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Properties Simple | Detailed

Formula C13H26O2
IUPAC Name isohexyl 4,4-dimethylpentanoate
Molecular Mass 214.344 g·mol−1
Heat of Formation -632.4 ± 16.7 kJ·mol−1
Dipole Moment 1.96 ± 1.08 D
Volume 313.51 Å 3
Surface Area 296.07 Å 2
HOMO Energy -10.65 ± 0.55 eV
LUMO Energy 0.95 ± eV
Point Group Symmetry C1
InChIKey TXTFODLIYQSBKN-UHFFFAOYSA-N
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Elements H C O