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Substance Name: Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,2-propanediyl ester
RN: 14496-66-3
InChIKey: XBGRDKKBYZSYFW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-Cl2-O6

Molecular Weight

  • 469.358
 
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Names and Synonyms

Synonyms

  • 1,2-Propanediol bis(alpha-(p-chlorophenoxy)isobutyrate)
  • BRN 1897439

Systematic Name

  • Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,2-propanediyl ester

Registry Numbers

CAS Registry Number

  • 14496-66-3

System Generated Number

  • 0014496663

Structure Descriptors

InChI

1S/C23H26Cl2O6/c1-15(29-21(27)23(4,5)31-19-12-8-17(25)9-13-19)14-28-20(26)22(2,3)30-18-10-6-16(24)7-11-18/h6-13,15H,14H2,1-5H3

InChIKey

XBGRDKKBYZSYFW-UHFFFAOYSA-N

Smiles

C([C@@H](C)OC(C(C)(C)Oc1ccc(cc1)Cl)=O)OC(C(C)(C)Oc1ccc(cc1)Cl)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3gm/kg (3000mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 90, Pg. 921, 1970.