Chem
J-GLOBAL ID：200907075339181764   Nikkaji number：J94.988D

2-Bromoterephthalic acid

2-ブロモテレフタル酸
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： C8H5BrO4
Molecular formula furigana： C8-H5-BR-O4
Molecular weight： 245.028
InChI： InChI=1S/C8H5BrO4/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI key： QPBGNSFASPVGTP-UHFFFAOYSA-N
SMILES： OC(=O)c1ccc(C(=O)O)c(Br)c1
Systematic name  (4)：
  • 2-ブロモテレフタル酸
  • 2-ブロモ-1,4-ベンゼンジカルボン酸
  • 2-ブロモベンゼン-1,4-ジカルボン酸
  • 2-bromobenzene-1,4-dicarboxylic acid
Other name (2)：
  • 2-Bromoterephthalic acid
  • 2-Bromo-1,4-benzenedicarboxylic acid
CAS registry number： 586-35-6
Regulation number (2)：
  • (3)-62
  • EINECS2095728
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