Homovanillyl Alcohol

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Properties Simple | Detailed

Formula C9H12O3
IUPAC Name 4-(2-hydroxyethyl)-2-methoxy-phenol
Molecular Mass 168.190 g·mol−1
Heat of Formation -471.3 ± 16.7 kJ·mol−1
Dipole Moment 3.43 ± 1.08 D
Volume 203.97 Å 3
Surface Area 199.88 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy 2.96 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methoxy-4-hydroxyphenylethanol
  • 4-(2-hydroxyethyl)-2-methoxyphenol
  • 4-(2-hydroxyethyl)guaiacol
  • 4-hydroxy-3-methoxyphenethanol
  • 4-hydroxy-3-methoxyphenethyl alcohol
  • 4-hydroxy-3-methoxyphenylethyl alcohol
  • benzeneethanol, 4-hydroxy-3-methoxy-
CAS Number(s)
  • 2380-78-1
InChIKey XHUBSJRBOQIZNI-UHFFFAOYSA-N
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