Chem
J-GLOBAL ID:201807009446208184   Nikkaji number:J3.725.075I

9,9′-[4-(Octyloxy)phenyliminobis(p-phenylene)bis[4-(octyloxy)phenylimino]]-10,10′-[4-(octyloxy)phenyliminobis(p-phenylene)bis[4-(octyloxy)phenylimino]]dianthracene

9,9′-[4-(オクチルオキシ)フェニルイミノビス(p-フェニレン)ビス[4-(オクチルオキシ)フェニルイミノ]]-10,10′-[4-(オクチルオキシ)フェニルイミノビス(p-フェニレン)ビス[4-(オクチルオキシ)フェニルイミノ]]ジアントラセン
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: C136H158N6O6
Molecular formula furigana: C136-H158-N6-O6
Molecular weight: 1972.796
InChI: InChI=1S/C136H158N6O6/c1-7-13-19-25-31-45-99-143-119-87-75-109(76-88-119)137-105-59-67-111(68-60-105)139(115-79-91-121(92-80-115)145-101-47-33-27-21-15-9-3)133-125-51-37-41-55-129(125)135(130-56-42-38-52-126(130)133)141(117-83-95-123(96-84-117)147-103-49-35-29-23-17-11-5)113-71-63-107(64-72-113)138(110-77-89-120(90-78-110)144-100-46-32-26-20-14-8-2)108-65-73-114(74-66-108)142(118-85-97-124(98-86-118)148-104-50-36-30-24-18-12-6)136-131-57-43-39-53-127(131)134(128-54-40-44-58-132(128)136)140(112-69-61-106(137)62-70-112)116-81-93-122(94-82-116)146-102-48-34-28-22-16-10-4/h37-44,51-98H,7-36,45-50,99-104H2,1-6H3
InChI key: ZELDMZDNTGNYAP-UHFFFAOYSA-N
SMILES: CCCCCCCCOc1ccc(cc1)N1c2ccc(cc2)N(c2ccc(OCCCCCCCC)cc2)c2c3ccccc3c(N(c3ccc(OCCCCCCCC)cc3)c3ccc(cc3)N(c3ccc(OCCCCCCCC)cc3)c3ccc(cc3)N(c3ccc(OCCCCCCCC)cc3)c3c4ccccc4c(N(c4ccc(OCCCCCCCC)cc4)c4ccc1cc4)c1ccccc31)c1ccccc21
Systematic name  (3):
  • 9,9′-[4-(オクチルオキシ)フェニルイミノビス(p-フェニレン)ビス[4-(オクチルオキシ)フェニルイミノ]]-10,10′-[4-(オクチルオキシ)フェニルイミノビス(p-フェニレン)ビス[4-(オクチルオキシ)フェニルイミノ]]ジアントラセン
  • 2,7,12,21,26,31-ヘキサキス[4-(オクチルオキシ)フェニル]-2,7,12,21,26,31-ヘキサアザウンデカシクロ[30.6.6.613,20.23,6.28,11.222,25.227,30.014,19.033,38.039,44.049,54]オクタペンタコンタ-1(38),3,5,8,10,13,15,17,19,22,24,27,29,32,34,36,39,41,43,45,47,49,51,53,55,57-ヘキサコサエン
  • 2,7,12,21,26,31-hexakis[4-(octyloxy)phenyl]-2,7,12,21,26,31-hexaazaundecacyclo[30.6.6.613,20.23,6.28,11.222,25.227,30.014,19.033,38.039,44.049,54]octapentaconta-1(38),3,5,8,10,13,15,17,19,22,24,27,29,32,34,36,39,41,43,45,47,49,51,53,55,57-hexacosaene
Other name (1):
  • 9,9′-[4-(Octyloxy)phenyliminobis(p-phenylene)bis[4-(octyloxy)phenylimino]]-10,10′-[4-(octyloxy)phenyliminobis(p-phenylene)bis[4-(octyloxy)phenylimino]]dianthracene
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