Chem
J-GLOBAL ID：200907095182441083   Nikkaji number：J6.359B

Bromotiren

ブロモチレン
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： C9H9Br2NO3
Molecular formula furigana： C9-H9-BR2-N-O3
Molecular weight： 338.983
InChI： InChI=1S/C9H9Br2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)
InChI key： COESHZUDRKCEPA-UHFFFAOYSA-N
SMILES： NC(Cc1cc(Br)c(O)c(Br)c1)C(=O)O
Systematic name  (3)：
  • 3,5-ジブロモ-4-ヒドロキシ-α-アミノベンゼンプロピオン酸
  • 2-アミノ-3-(3,5-ジブロモ-4-ヒドロキシフェニル)プロパン酸
  • 2-amino-3-(3,5-dibromo-4-hydroxyphenyl)propanoic acid
Other name (3)：
  • ブロモチレン
  • Bromotiren
  • 3,5-Dibromo-4-hydroxy-α-aminobenzenepropionic acid
CAS registry number： 537-24-6
Regulation number (1)：
  • EINECS2086619
KEGG COMPOUND： C17080
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