3-Phenyl-1,3-Dimethylbutyl Acetate

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Properties Simple | Detailed

Formula C14H20O2
IUPAC Name [(1r)-1,3-dimethyl-3-phenyl-butyl] acetate
Molecular Mass 220.307 g·mol−1
Heat of Formation -432.1 ± 16.7 kJ·mol−1
Dipole Moment 2.40 ± 1.08 D
Volume 295.62 Å 3
Surface Area 248.24 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 3.35 ± eV
Point Group Symmetry C1
InChIKey MXIGGIZQUGDKAP-LLVKDONJSA-N
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Elements H C O