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Substance Name: 1,3-Benzodioxole-5-butanoic acid, alpha-hydroxy-gamma-oxo-
RN: 84609-14-3
InChIKey: FHPGAVJHVGTMET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H10-O6

Molecular Weight

  • 238.194
 
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Names and Synonyms

Synonyms

  • 4-(3,4-Methylenedioxyphenyl)-4-oxo-2-hydroxy butenoique acide
  • 4-(3,4-Methylenedioxyphenyl)-4-oxo-2-hydroxy butenoique acide [French]
  • alpha-Hydroxy-gamma-oxo-1,3-benzodioxole-5-butanoic acid

Systematic Name

  • 1,3-Benzodioxole-5-butanoic acid, alpha-hydroxy-gamma-oxo-

Registry Numbers

CAS Registry Number

  • 84609-14-3

System Generated Number

  • 0084609143

Structure Descriptors

InChI

1S/C11H10O6/c12-7(4-8(13)11(14)15)6-1-2-9-10(3-6)17-5-16-9/h1-3,8,13H,4-5H2,(H,14,15)

InChIKey

FHPGAVJHVGTMET-UHFFFAOYSA-N

Smiles

c1cc2c(cc1C(=O)CC(C(=O)O)O)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   French Demande Patent Document. Vol. #2504006,