5-Butyl-2-Methyl-4-Oxo-4,5-Dihydro-3-Furanolate

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Properties Simple | Detailed

Formula C9H13O3-
IUPAC Name 5-butyl-2-methyl-4-oxofuran-3-olate
Molecular Mass 169.198 g·mol−1
Heat of Formation 885.3 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 179.45 Å 3
Surface Area 186.53 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.25 ± eV
Point Group Symmetry Cs
InChIKey NSQYDLCQAQCMGE-ZETCQYMHSA-M
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Elements C O