Chem
J-GLOBAL ID：201607011065417011   Nikkaji number：J3.481.660C

4,4′′′-Didodecyl-3′,2′′-bis[5,6-bis(4-dodecylphenyl)-1,1′:4′,1′′-terbenzene-2′-yl]-1,1′:4′,1′′:4′′,1′′′-quaterbenzene

4,4′′′-ジドデシル-3′,2′′-ビス[5,6-ビス(4-ドデシルフェニル)-1,1′:4′,1′′-テルベンゼン-2′-イル]-1,1′:4′,1′′:4′′,1′′′-クアテルベンゼン
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： C156H202
Molecular formula furigana： C156-H202
Molecular weight： 2077.331
InChI： InChI=1S/C156H202/c1-7-13-19-25-31-37-43-49-55-63-75-125-89-101-133(102-90-125)141-113-117-145(151(123-141)153-121-139(131-81-69-61-70-82-131)115-119-147(153)149-87-73-85-143(135-105-93-127(94-106-135)77-65-57-51-45-39-33-27-21-15-9-3)155(149)137-109-97-129(98-110-137)79-67-59-53-47-41-35-29-23-17-11-5)146-118-114-142(134-103-91-126(92-104-134)76-64-56-50-44-38-32-26-20-14-8-2)124-152(146)154-122-140(132-83-71-62-72-84-132)116-120-148(154)150-88-74-86-144(136-107-95-128(96-108-136)78-66-58-52-46-40-34-28-22-16-10-4)156(150)138-111-99-130(100-112-138)80-68-60-54-48-42-36-30-24-18-12-6/h61-62,69-74,81-124H,7-60,63-68,75-80H2,1-6H3
InChI key： GKGPPFNCUDKIEV-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCc1ccc(cc1)c1ccc(c2ccc(cc2c2cc(ccc2c2cccc(c3ccc(CCCCCCCCCCCC)cc3)c2c2ccc(CCCCCCCCCCCC)cc2)c2ccccc2)c2ccc(CCCCCCCCCCCC)cc2)c(c1)c1cc(ccc1c1cccc(c2ccc(CCCCCCCCCCCC)cc2)c1c1ccc(CCCCCCCCCCCC)cc1)c1ccccc1
Systematic name  (3)：
  • 4,4′′′-ジドデシル-3′,2′′-ビス[5,6-ビス(4-ドデシルフェニル)-1,1′:4′,1′′-テルベンゼン-2′-イル]-1,1′:4′,1′′:4′′,1′′′-クアテルベンゼン
  • 4'-ドデシル-4-(4'-ドデシル-3-{4-[4'-ドデシル-6-(4-ドデシルフェニル)-[1,1'-ビフェニル]-2-イル]-[1,1'-ビフェニル]-3-イル}-[1,1'-ビフェニル]-4-イル)-3-{4-[4'-ドデシル-6-(4-ドデシルフェニル)-[1,1'-ビフェニル]-2-イル]-[1,1'-ビフェニル]-3-イル}-1,1'-ビフェニル
  • 4'-dodecyl-4-(4'-dodecyl-3-{4-[4'-dodecyl-6-(4-dodecylphenyl)-[1,1'-biphenyl]-2-yl]-[1,1'-biphenyl]-3-yl}-[1,1'-biphenyl]-4-yl)-3-{4-[4'-dodecyl-6-(4-dodecylphenyl)-[1,1'-biphenyl]-2-yl]-[1,1'-biphenyl]-3-yl}-1,1'-biphenyl
Other name (1)：
  • 4,4′′′-Didodecyl-3′,2′′-bis[5,6-bis(4-dodecylphenyl)-1,1′:4′,1′′-terbenzene-2′-yl]-1,1′:4′,1′′:4′′,1′′′-quaterbenzene
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