(2R)-5-Hydroxy-7-(Hydroxymethyl)-2-Methyl-2-[(2S)-5-Oxotetrahydro-2-Furanyl]-2,3-Dihydro-4H-Chromen-4-One

Molecule SVG Image

Properties Simple | Detailed

Formula C15H16O6
IUPAC Name (2r)-5-hydroxy-7-(hydroxymethyl)-2-methyl-2-[(2s)-5-oxotetrahydrofuran-2-yl]chroman-4-one
Molecular Mass 292.284 g·mol−1
Heat of Formation -998.9 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 328.74 Å 3
Surface Area 287.95 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-5-hydroxy-2-[(2s)-5-ketotetrahydrofuran-2-yl]-2-methyl-7-methylol-chroman-4-one
  • (2r)-5-hydroxy-7-(hydroxymethyl)-2-methyl-2-[(2s)-5-oxo-2-tetrahydrofuranyl]-4-chromanone
  • (2r)-5-hydroxy-7-(hydroxymethyl)-2-methyl-2-[(2s)-5-oxooxolan-2-yl]chroman-4-one
  • (2r)-5-hydroxy-7-(hydroxymethyl)-2-methyl-2-[(2s)-5-oxotetrahydrofuran-2-yl]chroman-4-one
InChIKey UTMLPTPULBHGMZ-SWLSCSKDSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O