Chem
J-GLOBAL ID：200907025997666642   Nikkaji number：J27.656A

5-Aminoisophthalic acid

5-アミノイソフタル酸
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： C8H7NO4
Molecular formula furigana： C8-H7-N-O4
Molecular weight： 181.147
InChI： InChI=1S/C8H7NO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3H,9H2,(H,10,11)(H,12,13)
InChI key： KBZFDRWPMZESDI-UHFFFAOYSA-N
SMILES： Nc1cc(cc(c1)C(=O)O)C(=O)O
Systematic name  (4)：
  • 5-アミノ-1,3-ベンゼンジカルボン酸
  • 5-アミノイソフタル酸
  • 5-アミノベンゼン-1,3-ジカルボン酸
  • 5-aminobenzene-1,3-dicarboxylic acid
Other name (2)：
  • 5-Aminoisophthalic acid
  • 5-Amino-1,3-benzenedicarboxylic acid
CAS registry number： 99-31-0
Regulation number (4)：
  • 4-(4)-32
  • 4-(4)-87
  • EINECS2027485
  • TSCA(99-31-0)
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