Chem
J-GLOBAL ID：200907045115368811   Nikkaji number：J236.314C

Malonic acid 1-benzyl 3-methyl ester

マロン酸1-ベンジル3-メチル
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： C11H12O4
Molecular formula furigana： C11-H12-O4
Molecular weight： 208.213
InChI： InChI=1S/C11H12O4/c1-14-10(12)7-11(13)15-8-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChI key： IAUZDBFOEWAQFE-UHFFFAOYSA-N
SMILES： COC(=O)CC(=O)OCc1ccccc1
Systematic name  (4)：
  • マロン酸1-ベンジル3-メチル
  • プロパン二酸1-メチル3-ベンジル
  • 1-ベンジル 3-メチル プロパンジオアート
  • 1-benzyl 3-methyl propanedioate
Other name (2)：
  • Malonic acid 1-benzyl 3-methyl ester
  • Propanedioic acid 1-methyl 3-benzyl ester
CAS registry number： 52267-39-7
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