Chem
J-GLOBAL ID:200907015274631411   Nikkaji number:J2.040.171K

3,5-Difluoro-4′′-butoxy-1,1′:4′,1′′-terbenzene-4-yl isothiocyanate

4'-(4-ブトキシフェニル)-3,5-ジフルオロ-4-イソチオシアナト-1,1'-ビフェニル
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: C23H19F2NOS
Molecular formula furigana: C23-H19-F2-N-O-S
Molecular weight: 395.470
InChI: InChI=1S/C23H19F2NOS/c1-2-3-12-27-20-10-8-17(9-11-20)16-4-6-18(7-5-16)19-13-21(24)23(26-15-28)22(25)14-19/h4-11,13-14H,2-3,12H2,1H3
InChI key: UXZQIXKPDMKNNC-UHFFFAOYSA-N
SMILES: CCCCOc1ccc(cc1)c1ccc(cc1)c1cc(F)c(N=C=S)c(F)c1
Systematic name  (3):
  • 3,5-ジフルオロ-4′′-ブトキシ-1,1′:4′,1′′-テルベンゼン-4-イルイソチオシアナート
  • 4'-(4-ブトキシフェニル)-3,5-ジフルオロ-4-イソチオシアナト-1,1'-ビフェニル
  • 4'-(4-butoxyphenyl)-3,5-difluoro-4-isothiocyanato-1,1'-biphenyl
Other name (1):
  • 3,5-Difluoro-4′′-butoxy-1,1′:4′,1′′-terbenzene-4-yl isothiocyanate
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