Chem
J-GLOBAL ID：200907071900645222   Nikkaji number：J183.081C

2-Methylbutyric acid isobutyl ester

2-メチル酪酸イソブチル
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： C9H18O2
Molecular formula furigana： C9-H18-O2
Molecular weight： 158.241
InChI： InChI=1S/C9H18O2/c1-5-8(4)9(10)11-6-7(2)3/h7-8H,5-6H2,1-4H3
InChI key： NWZQCEQAPBRMFX-UHFFFAOYSA-N
SMILES： CCC(C)C(=O)OCC(C)C
Systematic name  (5)：
  • 2-メチルブタン酸イソブチル
  • 2-メチルブタン酸2-メチルプロピル
  • 2-メチル酪酸イソブチル
  • 2-メチルプロピル 2-メチルブタノアート
  • 2-methylpropyl 2-methylbutanoate
Other name (2)：
  • 2-Methylbutanoic acid 2-methylpropyl ester
  • 2-Methylbutyric acid isobutyl ester
CAS registry number： 2445-67-2
Regulation number (3)：
  • EINECS2194925
  • TSCA(2445-67-2)
  • (2)-776
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