Chem
J-GLOBAL ID：200907098841732138   Nikkaji number：J1.135.558G

4-Isocyanobenzoic acid ethyl ester

4-イソシアノ安息香酸エチル
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： C9[C-]H9[N+]O2
Molecular formula furigana： C10-H9-N-O2
Molecular weight： 175.187
InChI： InChI=1S/C10H9NO2/c1-3-13-10(12)8-4-6-9(11-2)7-5-8/h4-7H,3H2,1H3
InChI key： AUCNDAZBLKMEEM-UHFFFAOYSA-N
SMILES： CCOC(=O)c1ccc(cc1)[N+]#[C-]
Systematic name  (4)：
  • 4-イソシアノ安息香酸エチル
  • 4-(エトキシカルボニル)フェニルイソシアニド
  • 1-(エトキシカルボニル)-4-イソシアノベンゼン
  • 1-(ethoxycarbonyl)-4-isocyanobenzene
Other name (2)：
  • 4-Isocyanobenzoic acid ethyl ester
  • 4-(Ethoxycarbonyl)phenyl isocyanide
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