3-(1-Hydroxybutyl)-4-Methyldihydro-2(3H)-Furanone

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Properties Simple | Detailed

Formula C9H16O3
IUPAC Name (3r,4s)-3-[(1r)-1-hydroxybutyl]-4-methyl-tetrahydrofuran-2-one
Molecular Mass 172.222 g·mol−1
Heat of Formation -655.5 ± 16.7 kJ·mol−1
Dipole Moment 5.66 ± 1.08 D
Volume 223.02 Å 3
Surface Area 211.54 Å 2
HOMO Energy -10.55 ± 0.55 eV
LUMO Energy 0.90 ± eV
Point Group Symmetry C1
InChIKey LGIWBHBXTVSVNT-BWZBUEFSSA-N
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Elements H C O