3,3-Dimethylbutyl 4,4-Dimethylpentanoate

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Properties Simple | Detailed

Formula C13H26O2
IUPAC Name 3,3-dimethylbutyl 4,4-dimethylpentanoate
Molecular Mass 214.344 g·mol−1
Heat of Formation -637.0 ± 16.7 kJ·mol−1
Dipole Moment 1.98 ± 1.08 D
Volume 313.68 Å 3
Surface Area 289.34 Å 2
HOMO Energy -10.61 ± 0.55 eV
LUMO Energy 4.28 ± eV
Point Group Symmetry Cs
InChIKey LJMDCQIABIQHKS-UHFFFAOYSA-N
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Elements H C O