Chem
J-GLOBAL ID：200907051273716797   Nikkaji number：J1.541.828A

Terephthalic acid bis[2-(3-dodecyl-4-methylthiazolium-5-yl)ethyl] ester

テレフタル酸ビス[2-(3-ドデシル-4-メチルチアゾリウム-5-イル)エチル]
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： C44H70[N+]2O4S2
Molecular formula furigana： C44-H70-N2-O4-S2
Molecular weight： 755.170
InChI： InChI=1S/C44H70N2O4S2/c1-5-7-9-11-13-15-17-19-21-23-31-45-35-51-41(37(45)3)29-33-49-43(47)39-25-27-40(28-26-39)44(48)50-34-30-42-38(4)46(36-52-42)32-24-22-20-18-16-14-12-10-8-6-2/h25-28,35-36H,5-24,29-34H2,1-4H3/q+2
InChI key： LKJIFHROGLJBGX-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCC[n+]1csc(CCOC(=O)c2ccc(cc2)C(=O)OCCc2sc[n+](CCCCCCCCCCCC)c2C)c1C
Systematic name  (4)：
  • 5,5′-[(1,4-フェニレン)ビスカルボニルビスオキシビスエチレン]ビス(3-ドデシル-4-メチルチアゾール-3-イウム)
  • テレフタル酸ビス[2-(3-ドデシル-4-メチルチアゾリウム-5-イル)エチル]
  • 3-ドデシル-5-[2-(4-{[2-(3-ドデシル-4-メチル-1,3-チアゾール-3-イウム-5-イル)エトキシ]カルボニル}ベンゾイルオキシ)エチル]-4-メチル-1,3-チアゾール-3-イウム
  • 3-dodecyl-5-[2-(4-{[2-(3-dodecyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethoxy]carbonyl}benzoyloxy)ethyl]-4-methyl-1,3-thiazol-3-ium
Other name (2)：
  • 5,5′-[(1,4-Phenylene)biscarbonylbisoxybisethylene]bis(3-dodecyl-4-methylthiazole-3-ium)
  • Terephthalic acid bis[2-(3-dodecyl-4-methylthiazolium-5-yl)ethyl] ester
Thsaurus map：
Thesaurus Map

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