Chem
J-GLOBAL ID：200907069191624220
Nikkaji number：J635.552H
4,4′,5,5′-Tetrakis(octyloxymethyl)-Δ2,2′-bi[1,3-dithiol]
4,4′,5,5′-テトラキス(オクチルオキシメチル)-Δ2,2′-ビ[1,3-ジチオール]
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
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
Molecular formula： C42H76O4S4
Molecular formula furigana： C42-H76-O4-S4
Molecular weight： 773.310
InChI：
InChI=1S/C42H76O4S4/c1-5-9-13-17-21-25-29-43-33-37-38(34-44-30-26-22-18-14-10-6-2)48-41(47-37)42-49-39(35-45-31-27-23-19-15-11-7-3)40(50-42)36-46-32-28-24-20-16-12-8-4/h5-36H2,1-4H3
InChI key：
HQKVMHIQSTZKFP-UHFFFAOYSA-N
SMILES：
CCCCCCCCOCC1=C(COCCCCCCCC)S/C(=C/2\SC(=C(COCCCCCCCC)S2)COCCCCCCCC)/S1
Systematic name (3)：
- 4,4′,5,5′-テトラキス(オクチルオキシメチル)-Δ2,2′-ビ[1,3-ジチオール]
- 2-{4,5-ビス[(オクチルオキシ)メチル]-2H-1,3-ジチオール-2-イリデン}-4,5-ビス[(オクチルオキシ)メチル]-2H-1,3-ジチオール
- 2-{4,5-bis[(octyloxy)methyl]-2H-1,3-dithiol-2-ylidene}-4,5-bis[(octyloxy)methyl]-2H-1,3-dithiole
- 4,4′,5,5′-Tetrakis(octyloxymethyl)-Δ2,2′-bi[1,3-dithiol]
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