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Substance Name: 4H-1-Benzopyran-6-acetic acid, 2,3-dimethyl-alpha-ethyl-4-oxo-
RN: 173469-72-2
InChIKey: IMLRUCVOPUBTAE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-O4

Molecular Weight

  • 260.2874
 
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Names and Synonyms

Synonyms

  • 2,3-Dimethyl-alpha-ethyl-4-oxo-4H-1-benzopyran-6-acetic acid
  • 2-(2,3-Dimethylchromon-6-yl)butanoic acid

Systematic Name

  • 4H-1-Benzopyran-6-acetic acid, 2,3-dimethyl-alpha-ethyl-4-oxo-

Registry Numbers

CAS Registry Number

  • 173469-72-2

System Generated Number

  • 0173469722

Structure Descriptors

InChI

1S/C15H16O4/c1-4-11(15(17)18)10-5-6-13-12(7-10)14(16)8(2)9(3)19-13/h5-7,11H,4H2,1-3H3,(H,17,18)

InChIKey

IMLRUCVOPUBTAE-UHFFFAOYSA-N

Smiles

CCC(c1ccc2c(c1)c(=O)c(c(o2)C)C)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD unreported > 2gm/kg (2000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 34, Pg. 879, 1995.