Chem
J-GLOBAL ID:200907025741036374   Nikkaji number:J1.440.164D

5,5′-[(Adamantane-2,2-diyl)bis(4,1-phenylene)bisoxy]bis(isobenzofuran-1,3-dione)

5,5′-[(アダマンタン-2,2-ジイル)ビス(4,1-フェニレン)ビスオキシ]ビス(イソベンゾフラン-1,3-ジオン)
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: C38H28O8
Molecular formula furigana: C38-H28-O8
Molecular weight: 612.634
InChI: InChI=1S/C38H28O8/c39-34-30-11-9-28(18-32(30)36(41)45-34)43-26-5-1-22(2-6-26)38(24-14-20-13-21(16-24)17-25(38)15-20)23-3-7-27(8-4-23)44-29-10-12-31-33(19-29)37(42)46-35(31)40/h1-12,18-21,24-25H,13-17H2/t20-,21-,24-,25?/m1/s1
InChI key: DSBBAYZFPBMFKB-ALRZUNIJSA-N
SMILES: O=C1OC(=O)c2cc(Oc3ccc(cc3)C3(C4C[C@@H]5C[C@@H](C4)C[C@H]3C5)c3ccc(Oc4ccc5C(=O)OC(=O)c5c4)cc3)ccc12
Systematic name  (3):
  • 5,5′-[(アダマンタン-2,2-ジイル)ビス(4,1-フェニレン)ビスオキシ]ビス(イソベンゾフラン-1,3-ジオン)
  • 5-{4-[(5s,7s)-2-{4-[(1,3-ジオキソ-1,3-ジヒドロ-2-ベンゾフラン-5-イル)オキシ]フェニル}アダマンタン-2-イル]フェノキシ}-1,3-ジヒドロ-2-ベンゾフラン-1,3-ジオン
  • 5-{4-[(5s,7s)-2-{4-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}adamantan-2-yl]phenoxy}-1,3-dihydro-2-benzofuran-1,3-dione
Other name (1):
  • 5,5′-[(Adamantane-2,2-diyl)bis(4,1-phenylene)bisoxy]bis(isobenzofuran-1,3-dione)
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