Vanillyl Methyl Ketone

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Properties Simple | Detailed

Formula C10H12O3
IUPAC Name 1-(4-hydroxy-3-methoxy-phenyl)propan-2-one
Molecular Mass 180.200 g·mol−1
Heat of Formation -447.2 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 221.6 Å 3
Surface Area 214.72 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-hydroxy-3-methoxy-phenyl)acetone
  • 1-(4-hydroxy-3-methoxyphenyl)-2-propanone
  • 1-(4-hydroxy-3-methoxyphenyl)acetone
  • 1-(4-hydroxy-3-methoxyphenyl)propan-2-one
  • 2-propanone, 1-(4-hydroxy-3-methoxyphenyl)-
  • 2-propanone, 1-(4-hydroxy-3-methoxyphenyl)- (8ci)(9ci)
  • 4-hydroxy-3-methoxyphenyl acetone
  • 4-hydroxy-3-methoxyphenylacetone
  • guaiacylacetone
CAS Number(s)
  • 2503-46-0
InChIKey LFVCJQWZGDLHSD-UHFFFAOYSA-N
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