Chem
J-GLOBAL ID：200907024496031640   Nikkaji number：J153H

Phenylmalonic acid

フェニルマロン酸
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： C9H8O4
Molecular formula furigana： C9-H8-O4
Molecular weight： 180.159
InChI： InChI=1S/C9H8O4/c10-8(11)7(9(12)13)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)(H,12,13)
InChI key： WWYDYZMNFQIYPT-UHFFFAOYSA-N
SMILES： OC(=O)C(C(=O)O)c1ccccc1
Systematic name  (4)：
  • 2-フェニルプロパン二酸
  • フェニルマロン酸
  • 2-フェニルマロン酸
  • 2-phenylpropanedioic acid
Other name (3)：
  • Phenylmalonic acid
  • 2-Phenylpropanedioic acid
  • 2-Phenylmalonic acid
CAS registry number： 2613-89-0
Regulation number (3)：
  • 4-(4)-504
  • EINECS2200446
  • TSCA(2613-89-0)
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