Methyl 4-Iodobenzoate

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Properties Simple | Detailed

Formula C8H7IO2
IUPAC Name methyl 4-iodobenzoate
Molecular Mass 262.044 g·mol−1
Heat of Formation -184.2 ± 16.7 kJ·mol−1
Dipole Moment 1.77 ± 1.08 D
Volume 203.85 Å 3
Surface Area 203.86 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.29 ± eV
Point Group Symmetry Cs
Synonyms
  • 11y-0831
  • 4-iodo-benzoic acid methyl ester
  • 4-iodobenzoic acid methyl ester
  • benzoic acid, 4-iodo-, methyl ester
  • benzoic acid, p-iodo-, methyl ester
  • benzoic acid, p-iodo-, methyl ester (8ci)
  • methyl p-iodobenzoate
CAS Number(s)
  • 619-44-3
InChIKey DYUWQWMXZHDZOR-UHFFFAOYSA-N
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