Chem
J-GLOBAL ID:200907026734405891
Nikkaji number:J2.242.955H
2,3:6,7-Bis[4-(hexyloxy)-1,2-phenylene(ethene-1,2-diyl)]benzo[1,2-b:4,5-b′]dithiophene
2,3:6,7-ビス[4-(ヘキシルオキシ)-1,2-フェニレン(エテン-1,2-ジイル)]ベンゾ[1,2-b:4,5-b′]ジチオフェン
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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:
C38 H38 O2 S2
Molecular formula furigana:
C38-H38-O2-S2
Molecular weight:
590.840
InChI:
InChI=1S/C38H38O2S2/c1-3-5-7-9-19-39-27-13-17-29-25(21-27)11-15-31-33-23-36-34(24-35(33)41-37(29)31)32-16-12-26-22-28(40-20-10-8-6-4-2)14-18-30(26)38(32)42-36/h11-18,21-24H,3-10,19-20H2,1-2H3
InChI key:
GKIIXNGCOMFBKY-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc2c3sc4cc5c(cc4c3ccc2c1)sc1c5ccc2cc(OCCCCCC)ccc12
Systematic name (3):
2,3:6,7-ビス[4-(ヘキシルオキシ)-1,2-フェニレン(エテン-1,2-ジイル)]ベンゾ[1,2-b:4,5-b′]ジチオフェン
9,23-ビス(ヘキシルオキシ)-14,28-ジチアヘプタシクロ[15.11.0.03,15 .04,13 .07,12 .018,27 .021,26 ]オクタコサ-1,3(15),4(13),5,7,9,11,16,18(27),19,21,23,25-トリデカエン
9,23-bis(hexyloxy)-14,28-dithiaheptacyclo[15.11.0.03,15 .04,13 .07,12 .018,27 .021,26 ]octacosa-1,3(15),4(13),5,7,9,11,16,18(27),19,21,23,25-tridecaene
Other name (1):
2,3:6,7-Bis[4-(hexyloxy)-1,2-phenylene(ethene-1,2-diyl)]benzo[1,2-b:4,5-b′]dithiophene
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