(6S)-6-Cyclopentyl-6-[2-(3-Fluoro-4-Isopropoxyphenyl)Ethyl]-4-Hydroxy-5,6-Dihydro-2H-Pyran-2-One

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Properties Simple | Detailed

Formula C21H27FO4
IUPAC Name (2s)-2-cyclopentyl-2-[2-(3-fluoro-4-isopropoxy-phenyl)ethyl]-4-hydroxy-3h-pyran-6-one
Molecular Mass 362.435 g·mol−1
Heat of Formation -919.9 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 442.52 Å 3
Surface Area 385.42 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
InChIKey AKNIHFDXRAOPAI-NRFANRHFSA-N
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Elements H C O F