Chem
J-GLOBAL ID:200907037747947636   Nikkaji number:J1.940.309B

2-[2-Chloro-4-(trifluoromethyl)phenyl]-2,3,4,5,6,7-hexahydro-1,2-benzisothiazole-3-one

2-[2-クロロ-4-(トリフルオロメチル)フェニル]-2,3,4,5,6,7-ヘキサヒドロ-1,2-ベンゾチアゾール-3-オン
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: C14H11ClF3NOS
Molecular formula furigana: C14-H11-CL-F3-N-O-S
Molecular weight: 333.750
InChI: InChI=1S/C14H11ClF3NOS/c15-10-7-8(14(16,17)18)5-6-11(10)19-13(20)9-3-1-2-4-12(9)21-19/h5-7H,1-4H2
InChI key: DHHXUPAECPUDGT-UHFFFAOYSA-N
SMILES: FC(F)(F)c1ccc(c(Cl)c1)n1sc2CCCCc2c1=O
Systematic name  (3):
  • 2-[2-クロロ-4-(トリフルオロメチル)フェニル]-2,3,4,5,6,7-ヘキサヒドロ-1,2-ベンゾイソチアゾール-3-オン
  • 2-[2-クロロ-4-(トリフルオロメチル)フェニル]-2,3,4,5,6,7-ヘキサヒドロ-1,2-ベンゾチアゾール-3-オン
  • 2-[2-chloro-4-(trifluoromethyl)phenyl]-2,3,4,5,6,7-hexahydro-1,2-benzothiazol-3-one
Other name (1):
  • 2-[2-Chloro-4-(trifluoromethyl)phenyl]-2,3,4,5,6,7-hexahydro-1,2-benzisothiazole-3-one
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