Chem
J-GLOBAL ID:200907048296853669   Nikkaji number:J1.180K

Phenylacetic acid isobutyl

フェニル酢酸イソブチル
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: C12H16O2
Molecular formula furigana: C12-H16-O2
Molecular weight: 192.258
InChI: InChI=1S/C12H16O2/c1-10(2)9-14-12(13)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI key: RJASFPFZACBKBE-UHFFFAOYSA-N
SMILES: CC(C)COC(=O)Cc1ccccc1
Systematic name  (6):
  • ベンゼン酢酸イソブチル
  • フェニル酢酸2-メチルプロピル
  • フェニル酢酸イソブチル
  • フェニル酢酸(2-メチルプロピル)
  • 2-メチルプロピル 2-フェニルアセタート
Show all
Other name (3):
  • Phenylacetic acid isobutyl
  • Phenylacetic acid isobutyl ester
  • Phenylacetic acid (2-methylpropyl) ester
CAS registry number: 102-13-6
Regulation number (3):
  • EINECS2030079
  • (3)-1730
  • TSCA(102-13-6)
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