Chem
J-GLOBAL ID:200907016893861959   Nikkaji number:J266.280I

1,1-Bis(3,4-diethyl-2-hydroxyphenyl)-1,3-dihydro-3-oxoisobenzofuran-5-carboxylic acid

1,1-ビス(3,4-ジエチル-2-ヒドロキシフェニル)-1,3-ジヒドロ-3-オキソイソベンゾフラン-5-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: C29H30O6
Molecular formula furigana: C29-H30-O6
Molecular weight: 474.553
InChI: InChI=1S/C29H30O6/c1-5-16-9-13-23(25(30)19(16)7-3)29(24-14-10-17(6-2)20(8-4)26(24)31)22-12-11-18(27(32)33)15-21(22)28(34)35-29/h9-15,30-31H,5-8H2,1-4H3,(H,32,33)
InChI key: QSFBCYJLAJPRMK-UHFFFAOYSA-N
SMILES: CCc1ccc(c(O)c1CC)C1(OC(=O)c2cc(ccc12)C(=O)O)c1ccc(CC)c(CC)c1O
Systematic name  (3):
  • 1,1-ビス(3,4-ジエチル-2-ヒドロキシフェニル)-1,3-ジヒドロ-3-オキソイソベンゾフラン-5-カルボン酸
  • 1,1-ビス(3,4-ジエチル-2-ヒドロキシフェニル)-3-オキソ-1,3-ジヒドロ-2-ベンゾフラン-5-カルボン酸
  • 1,1-bis(3,4-diethyl-2-hydroxyphenyl)-3-oxo-1,3-dihydro-2-benzofuran-5-carboxylic acid
Other name (1):
  • 1,1-Bis(3,4-diethyl-2-hydroxyphenyl)-1,3-dihydro-3-oxoisobenzofuran-5-carboxylic acid
Regulation number (1):
  • (5)-3918
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