2-(4-Acetoxyphenyl)-3-Ethyl-1-Methyl-6-Indenyl Acetat

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Properties Simple | Detailed

Formula C22H22O4
IUPAC Name [4-[(1r)-6-acetoxy-3-ethyl-1-methyl-1h-inden-2-yl]phenyl] acetate
Molecular Mass 350.408 g·mol−1
Heat of Formation -564.9 ± 16.7 kJ·mol−1
Dipole Moment 1.55 ± 1.08 D
Volume 427.15 Å 3
Surface Area 376.93 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
InChIKey NXGLCYKRNZCWKF-CYBMUJFWSA-N
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Elements H C O