Methyl 4-Hydroxy-3-Iodo-5,6-Dimethoxy-2-Methylbenzoate

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Properties Simple | Detailed

Formula C11H13IO5
IUPAC Name methyl 4-hydroxy-5-iodo-2,3-dimethoxy-6-methyl-benzoate
Molecular Mass 352.122 g·mol−1
Heat of Formation -684.8 ± 16.7 kJ·mol−1
Dipole Moment 1.46 ± 1.08 D
Volume 299.24 Å 3
Surface Area 270.73 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • 4-hydroxy-5-iodo-2,3-dimethoxy-6-methyl-benzoic acid methyl ester
  • 4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzoic acid methyl ester
  • benzoic acid, 4-hydroxy-3-iodo-5,6-dimethoxy-2-methyl-, methyl ester
  • hidm
  • methyl 4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzoate
CAS Number(s)
  • 127761-05-1
InChIKey DDAKTXCYCCRJKJ-UHFFFAOYSA-N
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