Chem
J-GLOBAL ID：200907061804168060   Nikkaji number：J294.931H

5-Iodoisophthalic acid

5-ヨードイソフタル酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C8H5IO4
Molecular formula furigana： C8-H5-I-O4
Molecular weight： 292.028
InChI： InChI=1S/C8H5IO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI key： QMDFYAWUWIIQFM-UHFFFAOYSA-N
SMILES： OC(=O)c1cc(I)cc(c1)C(=O)O
Systematic name  (4)：
  • 5-ヨードイソフタル酸
  • 5-ヨード-1,3-ベンゼンジカルボン酸
  • 5-ヨードベンゼン-1,3-ジカルボン酸
  • 5-iodobenzene-1,3-dicarboxylic acid
Other name (2)：
  • 5-Iodo-1,3-benzenedicarboxylic acid
  • 5-Iodoisophthalic acid
CAS registry number： 51839-16-8
Regulation number (2)：
  • EINECS2574665
  • TSCA(51839-16-8)
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