(1R,2S,5R)-2-(2-Hydroxy-2-Propanyl)-5-Methylcyclohexanol

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Properties Simple | Detailed

Formula C10H20O2
IUPAC Name (1r,2s,5r)-2-(1-hydroxy-1-methyl-ethyl)-5-methyl-cyclohexanol
Molecular Mass 172.265 g·mol−1
Heat of Formation -582.9 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 232.84 Å 3
Surface Area 206.92 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2s,5r)-2-(1-hydroxy-1-methyl-ethyl)-5-methyl-cyclohexan-1-ol
  • (1r,2s,5r)-2-(1-hydroxy-1-methylethyl)-5-methyl-1-cyclohexanol
  • (1r,2s,5r)-2-(2-hydroxypropan-2-yl)-5-methyl-cyclohexan-1-ol
InChIKey LMXFTMYMHGYJEI-HRDYMLBCSA-N
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