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Substance Name: Butanoic acid, 4-(2-hydroxy-5-(1-oxopropyl)phenoxy)-
RN: 137150-48-2
InChIKey: XKCVVOLOBWRONO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-O5

Molecular Weight

  • 252.2644
 
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Names and Synonyms

Synonyms

  • 4-(2-Hydroxy-5-propionylphenoxy)butyric acid
  • BRN 5340343

Systematic Name

  • Butanoic acid, 4-(2-hydroxy-5-(1-oxopropyl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 137150-48-2

System Generated Number

  • 0137150482

Structure Descriptors

InChI

1S/C13H16O5/c1-2-10(14)9-5-6-11(15)12(8-9)18-7-3-4-13(16)17/h5-6,8,15H,2-4,7H2,1H3,(H,16,17)

InChIKey

XKCVVOLOBWRONO-UHFFFAOYSA-N

Smiles

CCC(=O)c1ccc(c(c1)OCCCC(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 442, 1991.