3-(1-Benzofuran-2-Yl)-2,2-Dimethylpentanoic Acid

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Properties Simple | Detailed

Formula C15H18O3
IUPAC Name (3r)-3-(benzofuran-2-yl)-2,2-dimethyl-pentanoic acid
Molecular Mass 246.302 g·mol−1
Heat of Formation -482.2 ± 16.7 kJ·mol−1
Dipole Moment 1.54 ± 1.08 D
Volume 309.45 Å 3
Surface Area 269.92 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 2.67 ± eV
Point Group Symmetry C1
InChIKey DKKKSMSZSDVSSS-NSHDSACASA-N
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Elements H C O