Chem
J-GLOBAL ID：200907015972265184   Nikkaji number：J1.541.830C

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

テレフタル酸ビス[2-(3-テトラデシル-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： C48H78[N+]2O4S2
Molecular formula furigana： C48-H78-N2-O4-S2
Molecular weight： 811.280
InChI： InChI=1S/C48H78N2O4S2/c1-5-7-9-11-13-15-17-19-21-23-25-27-35-49-39-55-45(41(49)3)33-37-53-47(51)43-29-31-44(32-30-43)48(52)54-38-34-46-42(4)50(40-56-46)36-28-26-24-22-20-18-16-14-12-10-8-6-2/h29-32,39-40H,5-28,33-38H2,1-4H3/q+2
InChI key： ZERXRBKHUZVRLE-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCC[n+]1csc(CCOC(=O)c2ccc(cc2)C(=O)OCCc2sc[n+](CCCCCCCCCCCCCC)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-テトラデシル-4-メチルチアゾール-3-イウム)
  • テレフタル酸ビス[2-(3-テトラデシル-4-メチルチアゾリウム-5-イル)エチル]
  • 4-メチル-5-[2-(4-{[2-(4-メチル-3-テトラデシル-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]-3-テトラデシル-1,3-チアゾール-3-イウム
  • 4-methyl-5-[2-(4-{[2-(4-methyl-3-tetradecyl-1,3-thiazol-3-ium-5-yl)ethoxy]carbonyl}benzoyloxy)ethyl]-3-tetradecyl-1,3-thiazol-3-ium
Other name (2)：
  • 5,5′-[(1,4-Phenylene)biscarbonylbisoxybisethylene]bis(3-tetradecyl-4-methylthiazole-3-ium)
  • Terephthalic acid bis[2-(3-tetradecyl-4-methylthiazolium-5-yl)ethyl] ester
Thsaurus map：
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