Chem
J-GLOBAL ID：201707001947181580
Nikkaji number：J3.567.670H
2,7-Bis(9,9-dihexyl-9H-fluorene-2-yl)-N,N′-bis(2-octyldodecyl)-1,6-dithiadicyclopenta[b,g]naphthalene-4,5:9,10-bis(dicarbimide)
2,7-ビス(9,9-ジヘキシル-9H-フルオレン-2-イル)-N,N′-ビス(2-オクチルドデシル)-1,6-ジチアジシクロペンタ[b,g]ナフタレン-4,5:9,10-ビス(ジカルボイミド)
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： C108H150N2O4S2
Molecular formula furigana： C108-H150-N2-O4-S2
Molecular weight： 1604.520
InChI：
InChI=1S/C108H150N2O4S2/c1-9-17-25-33-37-39-43-47-59-79(57-45-41-35-27-19-11-3)77-109-103(111)95-87-75-93(81-65-67-85-83-61-49-51-63-89(83)107(91(85)73-81,69-53-29-21-13-5)70-54-30-22-14-6)116-102(87)100-98-96(104(112)110(106(100)114)78-80(58-46-42-36-28-20-12-4)60-48-44-40-38-34-26-18-10-2)88-76-94(115-101(88)99(97(95)98)105(109)113)82-66-68-86-84-62-50-52-64-90(84)108(92(86)74-82,71-55-31-23-15-7)72-56-32-24-16-8/h49-52,61-68,73-76,79-80H,9-48,53-60,69-72,77-78H2,1-8H3
InChI key：
ILYMLGHSQINKCB-UHFFFAOYSA-N
SMILES：
CCCCCCCCCCC(CCCCCCCC)Cn1c(=O)c2c3cc(sc3c3c4c2c(c2sc(cc2c4c(=O)n(CC(CCCCCCCC)CCCCCCCCCC)c3=O)c2ccc3c4ccccc4C(CCCCCC)(CCCCCC)c3c2)c1=O)c1ccc2c3ccccc3C(CCCCCC)(CCCCCC)c2c1
Systematic name (3)：
- 2,7-ビス(9,9-ジヘキシル-9H-フルオレン-2-イル)-N,N′-ビス(2-オクチルドデシル)-1,6-ジチアジシクロペンタ[b,g]ナフタレン-4,5:9,10-ビス(ジカルボイミド)
- 4,14-ビス(9,9-ジヘキシル-9H-フルオレン-2-イル)-9,19-ビス(2-オクチルドデシル)-3,13-ジチア-9,19-ジアザヘキサシクロ[9.9.2.02,6.07,22.012,16.017,21]ドコサ-1,4,6,11,14,16,21-ヘプタエン-8,10,18,20-テトラオン
- 4,14-bis(9,9-dihexyl-9H-fluoren-2-yl)-9,19-bis(2-octyldodecyl)-3,13-dithia-9,19-diazahexacyclo[9.9.2.02,6.07,22.012,16.017,21]docosa-1,4,6,11,14,16,21-heptaene-8,10,18,20-tetrone
- 2,7-Bis(9,9-dihexyl-9H-fluorene-2-yl)-N,N′-bis(2-octyldodecyl)-1,6-dithiadicyclopenta[b,g]naphthalene-4,5:9,10-bis(dicarbimide)
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