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Substance Name: 2H-1-Benzopyran-3,6-dicarboxylic acid, 2-oxo-, dimethyl ester
RN: 6468-66-2
InChIKey: MMXNNRGWPHCUFE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H10-O6

Molecular Weight

  • 262.216
 
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Names and Synonyms

Synonyms

  • 2-Oxo-2H-1-benzopyran-3,6-dicarboxylic acid dimethyl ester
  • 3,6-Dicarbomethoxycoumarin
  • 5-18-08-00673 (Beilstein Handbook Reference)
  • BRN 1390953
  • SC-353

Systematic Name

  • 2H-1-Benzopyran-3,6-dicarboxylic acid, 2-oxo-, dimethyl ester

Registry Numbers

CAS Registry Number

  • 6468-66-2

System Generated Number

  • 0006468662

Structure Descriptors

InChI

1S/C13H10O6/c1-17-11(14)7-3-4-10-8(5-7)6-9(12(15)18-2)13(16)19-10/h3-6H,1-2H3

InChIKey

MMXNNRGWPHCUFE-UHFFFAOYSA-N

Smiles

COC(=O)C1=Cc2cc(ccc2OC1=O)C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1250mg/kg (1250mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Arzneimittel-Forschung. Drug Research. Vol. 15, Pg. 910, 1965.