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Substance Name: Methyl 2-(2,3-dimethylchromon-6-yl)butanoate
RN: 173469-70-0
InChIKey: XTKBVMBADBILKW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H18-O4

Molecular Weight

  • 274.3142
 
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Names and Synonyms

Results Name

  • Methyl 2-(2,3-dimethylchromon-6-yl)butanoate

Synonyms

  • Methyl 2,3-dimethyl-alpha-ethyl-4-oxo-4H-1-benzopyran-6-acetate
  • Methyl 2-(2,3-dimethylchromon-6-yl)butanoate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 173469-70-0

System Generated Number

  • 0173469700

Structure Descriptors

InChI

1S/C16H18O4/c1-5-12(16(18)19-4)11-6-7-14-13(8-11)15(17)9(2)10(3)20-14/h6-8,12H,5H2,1-4H3

InChIKey

XTKBVMBADBILKW-UHFFFAOYSA-N

Smiles

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

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.