Chem
J-GLOBAL ID：200907041066278849   Nikkaji number：J1.541.825G

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

テレフタル酸ビス[2-(3-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： C40H62[N+]2O4S2
Molecular formula furigana： C40-H62-N2-O4-S2
Molecular weight： 699.060
InChI： InChI=1S/C40H62N2O4S2/c1-5-7-9-11-13-15-17-19-27-41-31-47-37(33(41)3)25-29-45-39(43)35-21-23-36(24-22-35)40(44)46-30-26-38-34(4)42(32-48-38)28-20-18-16-14-12-10-8-6-2/h21-24,31-32H,5-20,25-30H2,1-4H3/q+2
InChI key： AOLBWIIAUMEBEN-UHFFFAOYSA-N
SMILES： CCCCCCCCCC[n+]1csc(CCOC(=O)c2ccc(cc2)C(=O)OCCc2sc[n+](CCCCCCCCCC)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-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-デシル-4-メチルチアゾリウム-5-イル)エチル]
  • 3-デシル-5-[2-(4-{[2-(3-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-decyl-5-[2-(4-{[2-(3-decyl-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-decyl-4-methylthiazole-3-ium)
  • Terephthalic acid bis[2-(3-decyl-4-methylthiazolium-5-yl)ethyl] ester
Thsaurus map：
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