Chem
J-GLOBAL ID：200907001886860184   Nikkaji number：J266.388K

1,1-Bis(3-bromo-6-hydroxy-2,4-dimethylphenyl)-1,3-dihydro-3-oxoisobenzofuran-4-carboxylic acid

1,1-ビス(3-ブロモ-6-ヒドロキシ-2,4-ジメチルフェニル)-1,3-ジヒドロ-3-オキソイソベンゾフラン-4-カルボン酸
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： C25H20Br2O6
Molecular formula furigana： C25-H20-BR2-O6
Molecular weight： 576.237
InChI： InChI=1S/C25H20Br2O6/c1-10-8-16(28)19(12(3)21(10)26)25(20-13(4)22(27)11(2)9-17(20)29)15-7-5-6-14(23(30)31)18(15)24(32)33-25/h5-9,28-29H,1-4H3,(H,30,31)
InChI key： CWLDAUARXHATCO-UHFFFAOYSA-N
SMILES： Cc1cc(O)c(c(C)c1Br)C1(OC(=O)c2c1cccc2C(=O)O)c1c(O)cc(C)c(Br)c1C
Systematic name  (3)：
  • 1,1-ビス(3-ブロモ-6-ヒドロキシ-2,4-ジメチルフェニル)-1,3-ジヒドロ-3-オキソイソベンゾフラン-4-カルボン酸
  • 1,1-ビス(3-ブロモ-6-ヒドロキシ-2,4-ジメチルフェニル)-3-オキソ-1,3-ジヒドロ-2-ベンゾフラン-4-カルボン酸
  • 1,1-bis(3-bromo-6-hydroxy-2,4-dimethylphenyl)-3-oxo-1,3-dihydro-2-benzofuran-4-carboxylic acid
Other name (1)：
  • 1,1-Bis(3-bromo-6-hydroxy-2,4-dimethylphenyl)-1,3-dihydro-3-oxoisobenzofuran-4-carboxylic acid
Regulation number (1)：
  • (5)-3919
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