Chem
J-GLOBAL ID：200907041292549200   Nikkaji number：J2.103.407J

3-(Pentafluoroethyl)-4,4-bis(ethylthio)-3-butenoic acid ethyl ester

3-(ペンタフルオロエチル)-4,4-ビス(エチルチオ)-3-ブテン酸エチル
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： C12H17F5O2S2
Molecular formula furigana： C12-H17-F5-O2-S2
Molecular weight： 352.380
InChI： InChI=1S/C12H17F5O2S2/c1-4-19-9(18)7-8(10(20-5-2)21-6-3)11(13,14)12(15,16)17/h4-7H2,1-3H3
InChI key： NNBFJGXKCPASHN-UHFFFAOYSA-N
SMILES： CCOC(=O)CC(=C(SCC)SCC)C(F)(F)C(F)(F)F
Systematic name  (3)：
  • 3-(ペンタフルオロエチル)-4,4-ビス(エチルチオ)-3-ブテン酸エチル
  • エチル 3-[ビス(エチルスルファニル)メチリデン]-4,4,5,5,5-ペンタフルオロペンタノアート
  • ethyl 3-[bis(ethylsulfanyl)methylidene]-4,4,5,5,5-pentafluoropentanoate
Other name (1)：
  • 3-(Pentafluoroethyl)-4,4-bis(ethylthio)-3-butenoic acid ethyl ester
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