Chem
J-GLOBAL ID：200907094904125908   Nikkaji number：J1.261.747J

4-Methylbenzenesulfonic acid (2S)-2-amino-3-methylbutyl ester

4-メチルベンゼンスルホン酸(2S)-2-アミノ-3-メチルブチル
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： C12H19NO3S
Molecular formula furigana： C12-H19-N-O3-S
Molecular weight： 257.350
InChI： InChI=1S/C12H19NO3S/c1-9(2)12(13)8-16-17(14,15)11-6-4-10(3)5-7-11/h4-7,9,12H,8,13H2,1-3H3/t12-/m1/s1
InChI key： GXHOVBQQRIYPBU-GFCCVEGCSA-N
SMILES： CC(C)[C@H](N)COS(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • 4-メチルベンゼンスルホン酸(2S)-2-アミノ-3-メチルブチル
  • (2S)-2-アミノ-3-メチルブチル 4-メチルベンゼン-1-スルホナート
  • (2S)-2-amino-3-methylbutyl 4-methylbenzene-1-sulfonate
Other name (1)：
  • 4-Methylbenzenesulfonic acid (2S)-2-amino-3-methylbutyl ester
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