5-(2-Hydroxypropoxy)-4-Oxo-8-Propyl-4H-Chromene-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C16H18O6
IUPAC Name 5-[(2r)-2-hydroxypropoxy]-4-oxo-8-propyl-chromene-2-carboxylic acid
Molecular Mass 306.311 g·mol−1
Heat of Formation -946.7 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 360.5 Å 3
Surface Area 317.9 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
InChIKey YQCGBHBRCNCNLL-SECBINFHSA-N
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Elements H C O