2-[(1R,6S)-6-(2-Methoxy-2-Propanyl)-3-Methyl-2-Cyclohexen-1-Yl]-1,4-Benzenediol

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Properties Simple | Detailed

Formula C17H24O3
IUPAC Name 2-[(1r,6s)-6-(1-methoxy-1-methyl-ethyl)-3-methyl-cyclohex-2-en-1-yl]benzene-1,4-diol
Molecular Mass 276.371 g·mol−1
Heat of Formation -534.4 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 356.82 Å 3
Surface Area 291.18 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy 0.32 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(1r,6s)-6-(1-methoxy-1-methyl-ethyl)-3-methyl-1-cyclohex-2-enyl]benzene-1,4-diol
  • 2-[(1r,6s)-6-(1-methoxy-1-methyl-ethyl)-3-methyl-1-cyclohex-2-enyl]hydroquinone
  • 2-[(1r,6s)-6-(1-methoxy-1-methylethyl)-3-methyl-1-cyclohex-2-enyl]benzene-1,4-diol
  • 2-[(1r,6s)-6-(2-methoxypropan-2-yl)-3-methyl-1-cyclohex-2-enyl]benzene-1,4-diol
InChIKey YVRSQIWWSKXPTR-ZFWWWQNUSA-N
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