4-(Hydroxymethyl)-3-(1-Hydroxy-4-Methylhexyl)Dihydro-2(3H)-Furanone

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Properties Simple | Detailed

Formula C12H22O4
IUPAC Name (3r,4r)-4-(hydroxymethyl)-3-[(1r,4r)-1-hydroxy-4-methyl-hexyl]tetrahydrofuran-2-one
Molecular Mass 230.301 g·mol−1
Heat of Formation -879.2 ± 16.7 kJ·mol−1
Dipole Moment 5.02 ± 1.08 D
Volume 297.48 Å 3
Surface Area 266.34 Å 2
HOMO Energy -10.65 ± 0.55 eV
LUMO Energy 3.97 ± eV
Point Group Symmetry C1
InChIKey LOMGRMLVVBQVNJ-GWOFURMSSA-N
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Elements H C O