Chem
J-GLOBAL ID：200907055442787009   Nikkaji number：J2.354.982D

4-(1-Pentylheptyl)benzenesulfonate

4-(1-ペンチルヘプチル)ベンゼンスルホナート
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： C18H29O2[O-]S
Molecular formula furigana： C18-H29-O3-S
Molecular weight： 325.490
InChI： InChI=1S/C18H30O3S/c1-3-5-7-9-11-16(10-8-6-4-2)17-12-14-18(15-13-17)22(19,20)21/h12-16H,3-11H2,1-2H3,(H,19,20,21)/p-1
InChI key： GHNRTXCRBJQVGN-UHFFFAOYSA-M
SMILES： CCCCCCC(CCCCC)c1ccc(cc1)S(=O)(=O)[O-]
Systematic name  (3)：
  • 4-(1-ペンチルヘプチル)ベンゼンスルホナート
  • 4-(ドデカン-6-イル)ベンゼン-1-スルホナート
  • 4-(dodecan-6-yl)benzene-1-sulfonate
Other name (1)：
  • 4-(1-Pentylheptyl)benzenesulfonate
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