Chem
J-GLOBAL ID：201107053914576860   Nikkaji number：J2.973.733I

3-[(S)-2-Chloro-α-(nitromethyl)benzyl]-2,4-pentanedione

3-[(S)-2-クロロ-α-(ニトロメチル)ベンジル]-2,4-ペンタンジオン
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： C13H14Cl[N+]O3[O-]
Molecular formula furigana： C13-H14-CL-N-O4
Molecular weight： 283.710
InChI： InChI=1S/C13H14ClNO4/c1-8(16)13(9(2)17)11(7-15(18)19)10-5-3-4-6-12(10)14/h3-6,11,13H,7H2,1-2H3/t11-/m1/s1
InChI key： ZDGJUZABUUGDDU-LLVKDONJSA-N
SMILES： CC(=O)C([C@H](C[N+](=O)[O-])c1ccccc1Cl)C(=O)C
Systematic name  (5)：
  • 3-[(S)-2-クロロ-α-(ニトロメチル)ベンジル]-2,4-ペンタンジオン
  • 3-[(S)-1-(2-クロロフェニル)-2-ニトロエチル]-2,4-ペンタンジオン
  • 3-((S)-1-(2-クロロフェニル)-2-ニトロエチル)ペンタン-2,4-ジオン
  • 3-[(1S)-1-(2-クロロフェニル)-2-ニトロエチル]ペンタン-2,4-ジオン
  • 3-[(1S)-1-(2-chlorophenyl)-2-nitroethyl]pentane-2,4-dione
Other name (3)：
  • 3-[(S)-2-Chloro-α-(nitromethyl)benzyl]-2,4-pentanedione
  • 3-[(S)-1-(2-Chlorophenyl)-2-nitroethyl]-2,4-pentanedione
  • 3-((S)-1-(2-Chlorophenyl)-2-nitroethyl)pentane-2,4-dione
Thsaurus map：
Thesaurus Map

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