Chem
J-GLOBAL ID:200907075549299229   Nikkaji number:J959.868E

2-(3,3,3-Trifluoro-1-propynyl)benzenesulfonic acid sodium salt

2-(3,3,3-トリフルオロ-1-プロピニル)ベンゼンスルホン酸ナトリウム
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: C9H4F3NaO3S
Molecular formula furigana: C9-H4-F3-NA-O3-S
Molecular weight: 272.170
InChI: InChI=1S/C9H5F3O3S.Na/c10-9(11,12)6-5-7-3-1-2-4-8(7)16(13,14)15;/h1-4H,(H,13,14,15);/q;+1/p-1
InChI key: WSHVWCSUCFOTGS-UHFFFAOYSA-M
SMILES: FC(F)(F)C#Cc1ccccc1S(=O)(=O)O[Na]
Systematic name  (3):
  • 2-(3,3,3-トリフルオロ-1-プロピニル)ベンゼンスルホン酸ナトリウム
  • ナトリウム 2-(3,3,3-トリフルオロプロパ-1-イン-1-イル)ベンゼン-1-スルホナート
  • sodium 2-(3,3,3-trifluoroprop-1-yn-1-yl)benzene-1-sulfonate
Other name (1):
  • 2-(3,3,3-Trifluoro-1-propynyl)benzenesulfonic acid sodium salt
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