Chem
J-GLOBAL ID:200907001370034644   Nikkaji number:J2.040.172I

2-Fluoro-4-[[4-(1-butenyl)phenyl]ethynyl]phenyl isothiocyanate

2-フルオロ-4-[[4-(1-ブテニル)フェニル]エチニル]フェニルイソチオシアナート
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: C19H14FNS
Molecular formula furigana: C19-H14-F-N-S
Molecular weight: 307.390
InChI: InChI=1S/C19H14FNS/c1-2-3-4-15-5-7-16(8-6-15)9-10-17-11-12-19(21-14-22)18(20)13-17/h3-8,11-13H,2H2,1H3
InChI key: LLABGJQULGIWAO-UHFFFAOYSA-N
SMILES: CCC=Cc1ccc(cc1)C#Cc1ccc(N=C=S)c(F)c1
Systematic name  (3):
  • 2-フルオロ-4-[[4-(1-ブテニル)フェニル]エチニル]フェニルイソチオシアナート
  • 4-{2-[4-(ブタ-1-エン-1-イル)フェニル]エチニル}-2-フルオロ-1-イソチオシアナトベンゼン
  • 4-{2-[4-(but-1-en-1-yl)phenyl]ethynyl}-2-fluoro-1-isothiocyanatobenzene
Other name (1):
  • 2-Fluoro-4-[[4-(1-butenyl)phenyl]ethynyl]phenyl isothiocyanate
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