Chem
J-GLOBAL ID:201107047470512525
Nikkaji number:J2.900.798E
5-(1,3-Cyclopentadienyl)-3-hexyl-3′′′,4′-dimethoxy-5′′′-methyl-2,2′:5′,2′′:5′′,2′′′-quaterthiophene
5-(1,3-シクロペンタジエニル)-3-ヘキシル-3′′′,4′-ジメトキシ-5′′′-メチル-2,2′:5′,2′′:5′′,2′′′-クアテルチオフェン
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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:
C30 H32 O2 S4
Molecular formula furigana:
C30-H32-O2-S4
Molecular weight:
552.820
InChI:
InChI=1S/C30H32O2S4/c1-5-6-7-8-13-21-17-26(20-11-9-10-12-20)35-28(21)27-18-23(32-4)30(36-27)25-15-14-24(34-25)29-22(31-3)16-19(2)33-29/h9-11,14-18H,5-8,12-13H2,1-4H3
InChI key:
FNRICENKWNCMHN-UHFFFAOYSA-N
SMILES:
CCCCCCc1cc(sc1c1cc(OC)c(s1)c1ccc(s1)c1sc(C)cc1OC)C1=CC=CC1
Systematic name (3):
5-(1,3-シクロペンタジエニル)-3-ヘキシル-3′′′,4′-ジメトキシ-5′′′-メチル-2,2′:5′,2′′:5′′,2′′′-クアテルチオフェン
5-(シクロペンタ-1,3-ジエン-1-イル)-3-ヘキシル-4'-メトキシ-5'-{3'-メトキシ-5'-メチル-[2,2'-ビチオフェン]-5-イル}-2,2'-ビチオフェン
5-(cyclopenta-1,3-dien-1-yl)-3-hexyl-4'-methoxy-5'-{3'-methoxy-5'-methyl-[2,2'-bithiophen]-5-yl}-2,2'-bithiophene
Other name (1):
5-(1,3-Cyclopentadienyl)-3-hexyl-3′′′,4′-dimethoxy-5′′′-methyl-2,2′:5′,2′′:5′′,2′′′-quaterthiophene
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