Chem
J-GLOBAL ID:200907073922235560   Nikkaji number:J2.652.907G

4-[3,5-Bis[3,4-bis(4-hexyloxybenzyloxy)benzyloxy]benzyloxy]benzoic acid 2-(2-hydroxyethoxy)ethyl ester

4-[3,5-ビス[3,4-ビス(4-ヘキシルオキシベンジルオキシ)ベンジルオキシ]ベンジルオキシ]安息香酸2-(2-ヒドロキシエトキシ)エチル
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: C84H104O15
Molecular formula furigana: C84-H104-O15
Molecular weight: 1353.741
InChI: InChI=1S/C84H104O15/c1-5-9-13-17-46-88-73-33-21-65(22-34-73)58-96-80-43-29-69(55-82(80)98-60-67-25-37-75(38-26-67)90-48-19-15-11-7-3)62-94-78-53-71(64-93-77-41-31-72(32-42-77)84(86)92-52-51-87-50-45-85)54-79(57-78)95-63-70-30-44-81(97-59-66-23-35-74(36-24-66)89-47-18-14-10-6-2)83(56-70)99-61-68-27-39-76(40-28-68)91-49-20-16-12-8-4/h21-44,53-57,85H,5-20,45-52,58-64H2,1-4H3
InChI key: BMLZIZCTDVEBIR-UHFFFAOYSA-N
SMILES: CCCCCCOc1ccc(COc2ccc(COc3cc(COc4ccc(cc4)C(=O)OCCOCCO)cc(OCc4ccc(OCc5ccc(OCCCCCC)cc5)c(OCc5ccc(OCCCCCC)cc5)c4)c3)cc2OCc2ccc(OCCCCCC)cc2)cc1
Systematic name  (3):
  • 4-[3,5-ビス[3,4-ビス(4-ヘキシルオキシベンジルオキシ)ベンジルオキシ]ベンジルオキシ]安息香酸2-(2-ヒドロキシエトキシ)エチル
  • 2-(2-ヒドロキシエトキシ)エチル 4-{[3,5-ビス({[3,4-ビス({[4-(ヘキシルオキシ)フェニル]メトキシ})フェニル]メトキシ})フェニル]メトキシ}ベンゾアート
  • 2-(2-hydroxyethoxy)ethyl 4-{[3,5-bis({[3,4-bis({[4-(hexyloxy)phenyl]methoxy})phenyl]methoxy})phenyl]methoxy}benzoate
Other name (1):
  • 4-[3,5-Bis[3,4-bis(4-hexyloxybenzyloxy)benzyloxy]benzyloxy]benzoic acid 2-(2-hydroxyethoxy)ethyl ester
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