(2S)-4-Hydroxy-2-(2-Hydroxy-2-Propanyl)-5-(2-Methylbutanoyl)-9-Phenyl-2,3-Dihydro-7H-Furo[2,3-F]Chromen-7-One

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Properties Simple | Detailed

Formula C25H26O6
IUPAC Name (2s)-4-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-5-[(2r)-2-methylbutanoyl]-9-phenyl-2,3-dihydrofuro[2,3-f]chromen-7-one
Molecular Mass 422.470 g·mol−1
Heat of Formation -964.8 ± 16.7 kJ·mol−1
Dipole Moment 7.33 ± 1.08 D
Volume 493.43 Å 3
Surface Area 396.77 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
InChIKey NSWHDVGYGYSKPN-DYVFJYSZSA-N
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Elements H C O