Chem
J-GLOBAL ID:200907077643101389   Nikkaji number:J1.600.780C

2-Cyano-3-isopropylheptanoic acid ethyl ester

2-シアノ-3-イソプロピルヘプタン酸エチル
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: C13H23NO2
Molecular formula furigana: C13-H23-N-O2
Molecular weight: 225.332
InChI: InChI=1S/C13H23NO2/c1-5-7-8-11(10(3)4)12(9-14)13(15)16-6-2/h10-12H,5-8H2,1-4H3
InChI key: PETIKUYXELRSEZ-UHFFFAOYSA-N
SMILES: CCCCC(C(C)C)C(C#N)C(=O)OCC
Systematic name  (3):
  • 2-シアノ-3-イソプロピルヘプタン酸エチル
  • エチル 2-シアノ-3-(プロパン-2-イル)ヘプタノアート
  • ethyl 2-cyano-3-(propan-2-yl)heptanoate
Other name (1):
  • 2-Cyano-3-isopropylheptanoic acid ethyl ester
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