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Substance Name: Propionic acid, alpha-(p-chlorophenyl)-beta-(2-furyl)-
RN: 3459-56-1
InChIKey: DABUAUJNVONJSH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H11-Cl-O3

Molecular Weight

  • 250.68
 
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Names and Synonyms

Synonyms

  • 2-Furanpropanoic acid, alpha-(4-chlorophenyl)-
  • 5-18-06-00536 (Beilstein Handbook Reference)
  • alpha-(p-Chlorophenyl)-beta-(2-furyl)propionic acid
  • BRN 1288342

Systematic Name

  • Propionic acid, alpha-(p-chlorophenyl)-beta-(2-furyl)-

Registry Numbers

CAS Registry Number

  • 3459-56-1

System Generated Number

  • 0003459561

Structure Descriptors

InChI

1S/C13H11ClO3/c14-10-5-3-9(4-6-10)12(13(15)16)8-11-2-1-7-17-11/h1-7,12H,8H2,(H,15,16)

InChIKey

DABUAUJNVONJSH-UHFFFAOYSA-N

Smiles

C([C@@H](Cc1occc1)c1ccc(cc1)Cl)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 598, 1965.