(2S)-4-Hydroxy-2-[(1R)-1-Hydroxy-1,5-Dimethyl-Hex-4-Enyl]-5,5-Dimethyl-7-(2-Methylpropanoyl)-2,3-Dihydrobenzofuran-6-One

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Properties Simple | Detailed

Formula C22H32O5
IUPAC Name (2s)-4-hydroxy-2-[(1r)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-5,5-dimethyl-7-(2-methylpropanoyl)-2,3-dihydrobenzofuran-6-one
Molecular Mass 376.486 g·mol−1
Heat of Formation -983.4 ± 16.7 kJ·mol−1
Dipole Moment 6.30 ± 1.08 D
Volume 482.74 Å 3
Surface Area 393.62 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
InChIKey ALQDHJHJKOXPIG-OYHNWAKOSA-N
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Elements H C O