Chem
J-GLOBAL ID：200907003909001772   Nikkaji number：J2.040.176A

2,6-Difluoro-4-[[4-(1-butenyl)phenyl]ethynyl]phenyl isothiocyanate

2,6-ジフルオロ-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： C19H13F2NS
Molecular formula furigana： C19-H13-F2-N-S
Molecular weight： 325.380
InChI： InChI=1S/C19H13F2NS/c1-2-3-4-14-5-7-15(8-6-14)9-10-16-11-17(20)19(22-13-23)18(21)12-16/h3-8,11-12H,2H2,1H3
InChI key： PPKWLHNTRITUTC-UHFFFAOYSA-N
SMILES： CCC=Cc1ccc(cc1)C#Cc1cc(F)c(N=C=S)c(F)c1
Systematic name  (3)：
  • 2,6-ジフルオロ-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
  • 5-{2-[4-(ブタ-1-エン-1-イル)フェニル]エチニル}-1,3-ジフルオロ-2-イソチオシアナトベンゼン
  • 5-{2-[4-(but-1-en-1-yl)phenyl]ethynyl}-1,3-difluoro-2-isothiocyanatobenzene
Other name (1)：
  • 2,6-Difluoro-4-[[4-(1-butenyl)phenyl]ethynyl]phenyl isothiocyanate
Thsaurus map：
Thesaurus Map

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