Chem
J-GLOBAL ID：200907064040031098   Nikkaji number：J122.038A

Ethyl α-cyanobenzeneacetate

α-シアノベンゼン酢酸エチル
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： C11H11NO2
Molecular formula furigana： C11-H11-N-O2
Molecular weight： 189.214
InChI： InChI=1S/C11H11NO2/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChI key： SXIRJEDGTAKGKU-UHFFFAOYSA-N
SMILES： CCOC(=O)C(C#N)c1ccccc1
Systematic name  (9)：
  • α-シアノフェニル酢酸エチル
  • フェニルシアノ酢酸エチル
  • 2-シアノ-2-フェニル酢酸エチル
  • α-シアノベンゼン酢酸エチル
  • シアノ(フェニル)酢酸エチル
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Other name (8)：
  • α-Cyanobenzeneacetic acid ethyl ester
  • Cyano(phenyl)acetic acid ethyl ester
  • 2-Phenyl-2-cyanoacetic acid ethyl ester
  • Ethyl 2-cyano-2-phenylacetate
  • Ethyl α-cyanophenylacetate
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CAS registry number： 4553-07-5
Regulation number (1)：
  • EINECS2249214
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