Chem
J-GLOBAL ID：200907004986562449   Nikkaji number：J1.793K

Isobutyric acid 3-methylbutyl ester

イソ酪酸3-メチルブチル
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/c1-7(2)5-6-11-9(10)8(3)4/h7-8H,5-6H2,1-4H3
InChI key： VFTGLSWXJMRZNB-UHFFFAOYSA-N
SMILES： CC(C)CCOC(=O)C(C)C
Systematic name  (8)：
  • イソ酪酸イソペンチル
  • イソ酪酸イソアミル
  • イソ酪酸3-メチルブチル
  • 2-メチルプロピオン酸3-メチルブチル
  • 2-メチルプロパン酸3-メチルブチル
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Other name (7)：
  • Isobutyric acid isoamyl
  • Isobutyric acid isoamyl ester
  • Isobutyric acid isopentyl ester
  • Isobutyric acid 3-methylbutyl ester
  • 2-Methylpropionic acid 3-methylbutyl ester
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CAS registry number： 2050-01-3
Regulation number (2)：
  • EINECS2180781
  • TSCA(2050-01-3)
Thsaurus map：
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