(4S,5S)-5-Hydroxy-4-Methyl-3-Heptanone

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Properties Simple | Detailed

Formula C8H16O2
IUPAC Name (4s,5s)-5-hydroxy-4-methyl-heptan-3-one
Molecular Mass 144.211 g·mol−1
Heat of Formation -519.2 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 202.03 Å 3
Surface Area 194.73 Å 2
HOMO Energy -10.11 ± 0.55 eV
LUMO Energy 3.64 ± eV
Point Group Symmetry C1
InChIKey GEZUGFBWAPDBGZ-BQBZGAKWSA-N
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Elements H C O