6-[(2S)-2-Hydroxypropyl]-4-Oxo-4H-Chromene-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C13H12O5
IUPAC Name 6-[(2s)-2-hydroxypropyl]-4-oxo-chromene-2-carboxylic acid
Molecular Mass 248.231 g·mol−1
Heat of Formation -726.2 ± 16.7 kJ·mol−1
Dipole Moment 5.50 ± 1.08 D
Volume 280.33 Å 3
Surface Area 265.09 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy 1.79 ± eV
Point Group Symmetry C1
InChIKey QTCFCURJWADBRO-ZETCQYMHSA-O
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Elements H C O