Chem
J-GLOBAL ID：200907006266479008   Nikkaji number：J559.406E

Vanillic acid isopropyl ester

バニリン酸イソプロピル
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： C11H14O4
Molecular formula furigana： C11-H14-O4
Molecular weight： 210.229
InChI： InChI=1S/C11H14O4/c1-7(2)15-11(13)8-4-5-9(12)10(6-8)14-3/h4-7,12H,1-3H3
InChI key： LLBXZZOFEUAEOM-UHFFFAOYSA-N
SMILES： COc1cc(ccc1O)C(=O)OC(C)C
Systematic name  (4)：
  • 3-メトキシ-4-ヒドロキシ安息香酸イソプロピル
  • バニリン酸イソプロピル
  • プロパン-2-イル 4-ヒドロキシ-3-メトキシベンゾアート
  • propan-2-yl 4-hydroxy-3-methoxybenzoate
Other name (2)：
  • 3-Methoxy-4-hydroxybenzoic acid isopropyl ester
  • Vanillic acid isopropyl ester
Regulation number (1)：
  • (3)-1560
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