Chem
J-GLOBAL ID:200907025805847576   Nikkaji number:J2.189.933J

4-(Dodecyloxy)benzoic acid 4-[[[4′-[[4-[[5-(pentafluorophenoxy)-5-oxopentyl]oxy]benzoyl]oxy]-3-biphenylyl]oxy]carbonyl]phenyl ester

4-(ドデシルオキシ)安息香酸4-[[[4′-[[4-[[5-(ペンタフルオロフェノキシ)-5-オキソペンチル]オキシ]ベンゾイル]オキシ]-3-ビフェニリル]オキシ]カルボニル]フェニル
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: C56H53F5O10
Molecular formula furigana: C56-H53-F5-O10
Molecular weight: 981.022
InChI: InChI=1S/C56H53F5O10/c1-2-3-4-5-6-7-8-9-10-12-34-66-42-26-20-39(21-27-42)55(64)69-45-32-24-40(25-33-45)56(65)70-46-16-14-15-41(36-46)37-18-30-44(31-19-37)68-54(63)38-22-28-43(29-23-38)67-35-13-11-17-47(62)71-53-51(60)49(58)48(57)50(59)52(53)61/h14-16,18-33,36H,2-13,17,34-35H2,1H3
InChI key: QIROXLBYJJGXNP-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCOc1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)Oc1cccc(c1)c1ccc(OC(=O)c2ccc(OCCCCC(=O)Oc3c(F)c(F)c(F)c(F)c3F)cc2)cc1
Systematic name  (3):
  • 4-(ドデシルオキシ)安息香酸4-[[[4′-[[4-[[5-(ペンタフルオロフェノキシ)-5-オキソペンチル]オキシ]ベンゾイル]オキシ]-3-ビフェニリル]オキシ]カルボニル]フェニル
  • 4-({[4'-(4-{[5-オキソ-5-(2,3,4,5,6-ペンタフルオロフェノキシ)ペンチル]オキシ}ベンゾイルオキシ)-[1,1'-ビフェニル]-3-イル]オキシ}カルボニル)フェニル 4-(ドデシルオキシ)ベンゾアート
  • 4-({[4'-(4-{[5-oxo-5-(2,3,4,5,6-pentafluorophenoxy)pentyl]oxy}benzoyloxy)-[1,1'-biphenyl]-3-yl]oxy}carbonyl)phenyl 4-(dodecyloxy)benzoate
Other name (1):
  • 4-(Dodecyloxy)benzoic acid 4-[[[4′-[[4-[[5-(pentafluorophenoxy)-5-oxopentyl]oxy]benzoyl]oxy]-3-biphenylyl]oxy]carbonyl]phenyl ester
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