Chem
J-GLOBAL ID:200907003345263658   Nikkaji number:J2.237.515F

Bis[4-[4-(hexyloxy)benzoyloxy]benzoic acid](4-cyano-1,3-phenylene) ester

ビス[4-[4-(ヘキシルオキシ)ベンゾイルオキシ]安息香酸](4-シアノ-1,3-フェニレン)
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: C47H45NO10
Molecular formula furigana: C47-H45-N-O10
Molecular weight: 783.874
InChI: InChI=1S/C47H45NO10/c1-3-5-7-9-29-53-38-20-11-33(12-21-38)44(49)55-40-24-15-35(16-25-40)46(51)57-42-28-19-37(32-48)43(31-42)58-47(52)36-17-26-41(27-18-36)56-45(50)34-13-22-39(23-14-34)54-30-10-8-6-4-2/h11-28,31H,3-10,29-30H2,1-2H3
InChI key: OEDLQSHQJATYRI-UHFFFAOYSA-N
SMILES: CCCCCCOc1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)Oc1ccc(C#N)c(OC(=O)c2ccc(OC(=O)c3ccc(OCCCCCC)cc3)cc2)c1
Systematic name  (4):
  • ビス[4-[[4-(ヘキシルオキシ)ベンゾイル]オキシ]安息香酸]4-シアノ-1,3-フェニレン
  • ビス[4-[4-(ヘキシルオキシ)ベンゾイルオキシ]安息香酸](4-シアノ-1,3-フェニレン)
  • 4-[(4-シアノ-3-{4-[4-(ヘキシルオキシ)ベンゾイルオキシ]ベンゾイルオキシ}フェノキシ)カルボニル]フェニル 4-(ヘキシルオキシ)ベンゾアート
  • 4-[(4-cyano-3-{4-[4-(hexyloxy)benzoyloxy]benzoyloxy}phenoxy)carbonyl]phenyl 4-(hexyloxy)benzoate
Other name (2):
  • Bis[4-[[4-(hexyloxy)benzoyl]oxy]benzoic acid]4-cyano-1,3-phenylene ester
  • Bis[4-[4-(hexyloxy)benzoyloxy]benzoic acid](4-cyano-1,3-phenylene) ester
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