Chem
J-GLOBAL ID：200907056434032186   Nikkaji number：J2.372.418I

2′′,5′′-Bis[3,5-bis(dodecyloxy)benzyloxy]-1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′-quinquebenzene-4,4′′′′-diol

2′′,5′′-ビス[3,5-ビス(ドデシルオキシ)ベンジルオキシ]-1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′-キンクエベンゼン-4,4′′′′-ジオール
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： C92H130O8
Molecular formula furigana： C92-H130-O8
Molecular weight： 1364.044
InChI： InChI=1S/C92H130O8/c1-5-9-13-17-21-25-29-33-37-41-61-95-85-65-75(66-86(69-85)96-62-42-38-34-30-26-22-18-14-10-6-2)73-99-91-71-90(82-51-47-78(48-52-82)80-55-59-84(94)60-56-80)92(72-89(91)81-49-45-77(46-50-81)79-53-57-83(93)58-54-79)100-74-76-67-87(97-63-43-39-35-31-27-23-19-15-11-7-3)70-88(68-76)98-64-44-40-36-32-28-24-20-16-12-8-4/h45-60,65-72,93-94H,5-44,61-64,73-74H2,1-4H3
InChI key： RMJKNNGDISHADV-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCOc1cc(COc2cc(c(OCc3cc(OCCCCCCCCCCCC)cc(OCCCCCCCCCCCC)c3)cc2c2ccc(cc2)c2ccc(O)cc2)c2ccc(cc2)c2ccc(O)cc2)cc(OCCCCCCCCCCCC)c1
Systematic name  (3)：
  • 2′′,5′′-ビス[3,5-ビス(ドデシルオキシ)ベンジルオキシ]-1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′-キンクエベンゼン-4,4′′′′-ジオール
  • 4'-[2,5-ビス({[3,5-ビス(ドデシルオキシ)フェニル]メトキシ})-4-{4'-ヒドロキシ-[1,1'-ビフェニル]-4-イル}フェニル]-[1,1'-ビフェニル]-4-オール
  • 4'-[2,5-bis({[3,5-bis(dodecyloxy)phenyl]methoxy})-4-{4'-hydroxy-[1,1'-biphenyl]-4-yl}phenyl]-[1,1'-biphenyl]-4-ol
Other name (1)：
  • 2′′,5′′-Bis[3,5-bis(dodecyloxy)benzyloxy]-1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′-quinquebenzene-4,4′′′′-diol
Thsaurus map：
Thesaurus Map

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