Chem
J-GLOBAL ID:200907018457812074   Nikkaji number:J905.214C

(S)-β-Formyl-4-chlorobenzenepropanoic acid ethyl ester

(S)-β-ホルミル-4-クロロベンゼンプロパン酸エチル
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: C12H13ClO3
Molecular formula furigana: C12-H13-CL-O3
Molecular weight: 240.680
InChI: InChI=1S/C12H13ClO3/c1-2-16-12(15)7-10(8-14)9-3-5-11(13)6-4-9/h3-6,8,10H,2,7H2,1H3/t10-/m1/s1
InChI key: XPYCQJBZWAMQBB-SNVBAGLBSA-N
SMILES: CCOC(=O)C[C@H](C=O)c1ccc(Cl)cc1
Systematic name  (3):
  • (S)-β-ホルミル-4-クロロベンゼンプロパン酸エチル
  • エチル (3S)-3-(4-クロロフェニル)-4-オキソブタノアート
  • ethyl (3S)-3-(4-chlorophenyl)-4-oxobutanoate
Other name (1):
  • (S)-β-Formyl-4-chlorobenzenepropanoic acid ethyl ester
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