Chem
J-GLOBAL ID：201007032544308432
Nikkaji number：J2.862.185J
4′,3′′′-Bis(carboxymethyl)-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-quinquethiophene-5,5′′′′-dicarboxylic acid
4′,3′′′-ビス(カルボキシメチル)-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-キンクエチオフェン-5,5′′′′-ジカルボン酸
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： C26H16O8S5
Molecular formula furigana： C26-H16-O8-S5
Molecular weight： 616.710
InChI：
InChI=1S/C26H16O8S5/c27-21(28)9-11-7-19(13-1-5-17(35-13)25(31)32)38-23(11)15-3-4-16(37-15)24-12(10-22(29)30)8-20(39-24)14-2-6-18(36-14)26(33)34/h1-8H,9-10H2,(H,27,28)(H,29,30)(H,31,32)(H,33,34)
InChI key：
SZFMXSCJFCPHEZ-UHFFFAOYSA-N
SMILES：
OC(=O)Cc1cc(sc1c1ccc(s1)c1sc(cc1CC(=O)O)c1ccc(s1)C(=O)O)c1ccc(s1)C(=O)O
Systematic name (3)：
- 4′,3′′′-ビス(カルボキシメチル)-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-キンクエチオフェン-5,5′′′′-ジカルボン酸
- 5'-{5-[5'-カルボキシ-4-(カルボキシメチル)-[2,2'-ビチオフェン]-5-イル]チオフェン-2-イル}-4'-(カルボキシメチル)-[2,2'-ビチオフェン]-5-カルボン酸
- 5'-{5-[5'-carboxy-4-(carboxymethyl)-[2,2'-bithiophen]-5-yl]thiophen-2-yl}-4'-(carboxymethyl)-[2,2'-bithiophene]-5-carboxylic acid
- 4′,3′′′-Bis(carboxymethyl)-2,2′:5′,2′′:5′′,2′′′:5′′′,2′′′′-quinquethiophene-5,5′′′′-dicarboxylic acid
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