Chem
J-GLOBAL ID：200907049876016930   Nikkaji number：J2.242.959K

2,6-Bis[4-(hexyloxy)phenyl]-3,7-bis(9-hydroxy-9H-fluorene-9-yl)benzo[1,2-b:4,5-b′]dithiophene

2,6-ビス[4-(ヘキシルオキシ)フェニル]-3,7-ビス(9-ヒドロキシ-9H-フルオレン-9-イル)ベンゾ[1,2-b:4,5-b′]ジチオフェン
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： C60H54O4S2
Molecular formula furigana： C60-H54-O4-S2
Molecular weight： 903.210
InChI： InChI=1S/C60H54O4S2/c1-3-5-7-17-35-63-41-31-27-39(28-32-41)57-55(59(61)49-23-13-9-19-43(49)44-20-10-14-24-50(44)59)47-37-54-48(38-53(47)65-57)56(58(66-54)40-29-33-42(34-30-40)64-36-18-8-6-4-2)60(62)51-25-15-11-21-45(51)46-22-12-16-26-52(46)60/h9-16,19-34,37-38,61-62H,3-8,17-18,35-36H2,1-2H3
InChI key： FRCHTEJEJUYVBV-UHFFFAOYSA-N
SMILES： CCCCCCOc1ccc(cc1)c1sc2cc3c(c(sc3cc2c1C1(O)c2ccccc2c2ccccc12)c1ccc(OCCCCCC)cc1)C1(O)c2ccccc2c2ccccc12
Systematic name  (3)：
  • 2,6-ビス[4-(ヘキシルオキシ)フェニル]-3,7-ビス(9-ヒドロキシ-9H-フルオレン-9-イル)ベンゾ[1,2-b:4,5-b′]ジチオフェン
  • 9-{5,11-ビス[4-(ヘキシルオキシ)フェニル]-12-(9-ヒドロキシ-9H-フルオレン-9-イル)-4,10-ジチアトリシクロ[7.3.0.03,7]ドデカ-1(9),2,5,7,11-ペンタエン-6-イル}-9H-フルオレン-9-オール
  • 9-{5,11-bis[4-(hexyloxy)phenyl]-12-(9-hydroxy-9H-fluoren-9-yl)-4,10-dithiatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7,11-pentaen-6-yl}-9H-fluoren-9-ol
Other name (1)：
  • 2,6-Bis[4-(hexyloxy)phenyl]-3,7-bis(9-hydroxy-9H-fluorene-9-yl)benzo[1,2-b:4,5-b′]dithiophene
Thsaurus map：
Thesaurus Map

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