Chem
J-GLOBAL ID：201007037664036870   Nikkaji number：J2.880.887I

3-[4-(2,4,4-Trimethylpentane-2-yl)phenoxy]-1-propanesulfonic acid potassium salt

3-[4-(2,4,4-トリメチルペンタン-2-イル)フェノキシ]-1-プロパンスルホン酸カリウム
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： C17H27KO4S
Molecular formula furigana： C17-H27-K-O4-S
Molecular weight： 366.560
InChI： InChI=1S/C17H28O4S.K/c1-16(2,3)13-17(4,5)14-7-9-15(10-8-14)21-11-6-12-22(18,19)20;/h7-10H,6,11-13H2,1-5H3,(H,18,19,20);/q;+1/p-1
InChI key： GAUBLRSDMXVSOT-UHFFFAOYSA-M
SMILES： CC(C)(C)CC(C)(C)c1ccc(OCCCS(=O)(=O)O[K])cc1
Systematic name  (3)：
  • 3-[4-(2,4,4-トリメチルペンタン-2-イル)フェノキシ]-1-プロパンスルホン酸カリウム
  • カリウム 3-[4-(2,4,4-トリメチルペンタン-2-イル)フェノキシ]プロパン-1-スルホナート
  • potassium 3-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]propane-1-sulfonate
Other name (1)：
  • 3-[4-(2,4,4-Trimethylpentane-2-yl)phenoxy]-1-propanesulfonic acid potassium salt
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