Chem
J-GLOBAL ID：200907010726838238   Nikkaji number：J107.433D

Crotonic acid octyl ester

クロトン酸オクチル
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： C12H22O2
Molecular formula furigana： C12-H22-O2
Molecular weight： 198.306
InChI： InChI=1S/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h4,10H,3,5-9,11H2,1-2H3/b10-4+
InChI key： HULBECQFWZPEBI-ONNFQVAWSA-N
SMILES： CCCCCCCCOC(=O)/C=C/C
Systematic name  (4)：
  • クロトン酸オクチル
  • (E)-2-ブテン酸オクチル
  • オクチル (2E)-ブタ-2-エノアート
  • octyl (2E)-but-2-enoate
Other name (2)：
  • Crotonic acid octyl ester
  • (E)-2-Butenoic acid octyl ester
Regulation number (1)：
  • (2)-966
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