Chem
J-GLOBAL ID：200907037525114695   Nikkaji number：J1.079.307F

4,4′-[Oxybis[carbonyl(ethane-1,1-diyl)(4,1-phenylene)oxy]]bisphthalic acid

4,4′-[オキシビス[カルボニル(エタン-1,1-ジイル)(4,1-フェニレン)オキシ]]ビスフタル酸
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： C34H26O13
Molecular formula furigana： C34-H26-O13
Molecular weight： 642.569
InChI： InChI=1S/C34H26O13/c1-17(19-3-7-21(8-4-19)45-23-11-13-25(29(35)36)27(15-23)31(39)40)33(43)47-34(44)18(2)20-5-9-22(10-6-20)46-24-12-14-26(30(37)38)28(16-24)32(41)42/h3-18H,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42)
InChI key： NHIAGALZMUNBMG-UHFFFAOYSA-N
SMILES： CC(C(=O)OC(=O)C(C)c1ccc(Oc2ccc(C(=O)O)c(c2)C(=O)O)cc1)c1ccc(Oc2ccc(C(=O)O)c(c2)C(=O)O)cc1
Systematic name  (3)：
  • 4,4′-[オキシビス[カルボニル(エタン-1,1-ジイル)(4,1-フェニレン)オキシ]]ビスフタル酸
  • 4-{4-[1-({2-[4-(3,4-ジカルボキシフェノキシ)フェニル]プロパノイル}オキシ)-1-オキソプロパン-2-イル]フェノキシ}ベンゼン-1,2-ジカルボン酸
  • 4-{4-[1-({2-[4-(3,4-dicarboxyphenoxy)phenyl]propanoyl}oxy)-1-oxopropan-2-yl]phenoxy}benzene-1,2-dicarboxylic acid
Other name (1)：
  • 4,4′-[Oxybis[carbonyl(ethane-1,1-diyl)(4,1-phenylene)oxy]]bisphthalic acid
Thsaurus map：
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