5-(3-Hydroxybutanoyl)-4-Methoxy-6-Methyl-2H-Pyran-2-One

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Properties Simple | Detailed

Formula C11H15O5+
IUPAC Name 5-[(3r)-3-hydroxybutanoyl]-4-methoxy-6-methyl-pyran-2-one
Molecular Mass 227.234 g·mol−1
Heat of Formation -835.6 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 262.28 Å 3
Surface Area 241.5 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry C1
InChIKey NXDGLHJHHJJTSZ-ZCFIWIBFSA-N
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