Chem
J-GLOBAL ID:200907087904874564   Nikkaji number:J2.306.464B

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

オクタン二酸ビス[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: C40H70[N+]2O4S2
Molecular formula furigana: C40-H70-N2-O4-S2
Molecular weight: 707.130
InChI: InChI=1S/C40H70N2O4S2/c1-5-7-9-11-13-15-19-23-29-41-33-47-37(35(41)3)27-31-45-39(43)25-21-17-18-22-26-40(44)46-32-28-38-36(4)42(34-48-38)30-24-20-16-14-12-10-8-6-2/h33-34H,5-32H2,1-4H3/q+2
InChI key: HWFBBVLXFXCEPX-UHFFFAOYSA-N
SMILES: CCCCCCCCCC[n+]1csc(CCOC(=O)CCCCCCC(=O)OCCc2sc[n+](CCCCCCCCCC)c2C)c1C
Systematic name  (3):
  • オクタン二酸ビス[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-({8-[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]-8-オキソオクタノイル}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-({8-[2-(3-decyl-4-methyl-1,3-thiazol-3-ium-5-yl)ethoxy]-8-oxooctanoyl}oxy)ethyl]-4-methyl-1,3-thiazol-3-ium
Other name (1):
  • Octanedioic acid bis[2-(3-decyl-4-methylthiazolium-5-yl)ethyl] ester
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