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Substance Name: 2H-1-Benzopyran-6-carboxylic acid, 3-acetyl-2-oxo-
RN: 6468-73-1
InChIKey: YZYOZBNENKHAAN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H8-O5

Molecular Weight

  • 232.1902
 
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Names and Synonyms

Synonyms

  • 3-Acetyl-2-oxo-2H-1-benzopyran-6-carboxylic acid
  • 3-Acetyl-6-carboxycoumarin
  • 5-18-08-00582 (Beilstein Handbook Reference)
  • BRN 1380320
  • SC-358

Systematic Name

  • 2H-1-Benzopyran-6-carboxylic acid, 3-acetyl-2-oxo-

Registry Numbers

CAS Registry Number

  • 6468-73-1

System Generated Number

  • 0006468731

Structure Descriptors

InChI

1S/C12H8O5/c1-6(13)9-5-8-4-7(11(14)15)2-3-10(8)17-12(9)16/h2-5H,1H3,(H,14,15)

InChIKey

YZYOZBNENKHAAN-UHFFFAOYSA-N

Smiles

CC(=O)C1=Cc2cc(ccc2OC1=O)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1200mg/kg (1200mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Arzneimittel-Forschung. Drug Research. Vol. 15, Pg. 910, 1965.