Chem
J-GLOBAL ID:201307077461574225   Nikkaji number:J3.156.146I

Pentafluorobenzoic acid 4′-(benzoyloxy)-2,2′,3,3′,5,5′,6,6′-octafluorobiphenyl-4-yl ester

ペンタフルオロ安息香酸4′-(ベンゾイルオキシ)-2,2′,3,3′,5,5′,6,6′-オクタフルオロビフェニル-4-イル
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: C26H5F13O4
Molecular formula furigana: C26-H5-F13-O4
Molecular weight: 628.301
InChI: InChI=1S/C26H5F13O4/c27-10-7(11(28)20(37)23(19(10)36)42-25(40)6-4-2-1-3-5-6)8-12(29)21(38)24(22(39)13(8)30)43-26(41)9-14(31)16(33)18(35)17(34)15(9)32/h1-5H
InChI key: VQZVHCJEZVGRIY-UHFFFAOYSA-N
SMILES: Fc1c(F)c(F)c(C(=O)Oc2c(F)c(F)c(c(F)c2F)c2c(F)c(F)c(OC(=O)c3ccccc3)c(F)c2F)c(F)c1F
Systematic name  (3):
  • ペンタフルオロ安息香酸4′-(ベンゾイルオキシ)-2,2′,3,3′,5,5′,6,6′-オクタフルオロビフェニル-4-イル
  • 4'-(ベンゾイルオキシ)-2,2',3,3',5,5',6,6'-オクタフルオロ-[1,1'-ビフェニル]-4-イル 2,3,4,5,6-ペンタフルオロベンゾアート
  • 4'-(benzoyloxy)-2,2',3,3',5,5',6,6'-octafluoro-[1,1'-biphenyl]-4-yl 2,3,4,5,6-pentafluorobenzoate
Other name (1):
  • Pentafluorobenzoic acid 4′-(benzoyloxy)-2,2′,3,3′,5,5′,6,6′-octafluorobiphenyl-4-yl ester
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