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Substance Name: p-Toluic acid, 2,6-diacetoxy-3,5-dichloro-
RN: 63980-09-6
InChIKey: YOFROOKXIBMQTF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H10-Cl2-O6

Molecular Weight

  • 321.111
 
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Names and Synonyms

Synonyms

  • 3-Methylbenzenamine hydrochloride
  • Benzoic acid, 2,6-bis(acetyloxy)-3,5-dichloro-4-methyl-
  • Benzoic acid, 2,6-diacetoxy-3,5-dichloro-4-methyl-

Systematic Name

  • p-Toluic acid, 2,6-diacetoxy-3,5-dichloro-

Registry Numbers

CAS Registry Number

  • 63980-09-6

System Generated Number

  • 0063980096

Structure Descriptors

InChI

1S/C12H10Cl2O6/c1-4-8(13)10(19-5(2)15)7(12(17)18)11(9(4)14)20-6(3)16/h1-3H3,(H,17,18)

InChIKey

YOFROOKXIBMQTF-UHFFFAOYSA-N

Smiles

c1(C(=O)O)c(c(Cl)c(C)c(c1OC(C)=O)Cl)OC(C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 390mg/kg (390mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 22, Pg. 221, 1964.