Chem
J-GLOBAL ID：200907038030308538   Nikkaji number：J785.286J

3,5-Bis[5-[3,5-bis(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]benzonitrile

3,5-ビス[5-[3,5-ビス(トリフルオロメチル)フェニル]-1,3,4-オキサジアゾール-2-イル]ベンゾニトリル
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： C27H9F12N5O2
Molecular formula furigana： C27-H9-F12-N5-O2
Molecular weight： 663.383
InChI： InChI=1S/C27H9F12N5O2/c28-24(29,30)16-4-14(5-17(8-16)25(31,32)33)22-43-41-20(45-22)12-1-11(10-40)2-13(3-12)21-42-44-23(46-21)15-6-18(26(34,35)36)9-19(7-15)27(37,38)39/h1-9H
InChI key： QBDGXXIMANIXES-UHFFFAOYSA-N
SMILES： FC(F)(F)c1cc(cc(c1)C(F)(F)F)c1nnc(o1)c1cc(cc(c1)c1nnc(o1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C#N
Systematic name  (3)：
  • 3,5-ビス[5-[3,5-ビス(トリフルオロメチル)フェニル]-1,3,4-オキサジアゾール-2-イル]ベンゾニトリル
  • 3,5-ビス({5-[3,5-ビス(トリフルオロメチル)フェニル]-1,3,4-オキサジアゾール-2-イル})ベンゾニトリル
  • 3,5-bis({5-[3,5-bis(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl})benzonitrile
Other name (1)：
  • 3,5-Bis[5-[3,5-bis(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]benzonitrile
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