(4S)-3,4-Bis(Hydroxymethyl)-5,5-Dimethyl-2-Cyclohexen-1-One

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Properties Simple | Detailed

Formula C10H16O3
IUPAC Name (4s)-3,4-bis(hydroxymethyl)-5,5-dimethyl-cyclohex-2-en-1-one
Molecular Mass 184.232 g·mol−1
Heat of Formation -571.5 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 234.63 Å 3
Surface Area 207.81 Å 2
HOMO Energy -9.96 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
InChIKey JPFJQHYDGYXING-SECBINFHSA-N
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