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Substance Name: Butanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester
RN: 67205-54-3
InChIKey: FCZWYAFKVWAXKA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H7-Cl4-N-O2

Molecular Weight

  • 326.9933
 
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Names and Synonyms

Synonym

  • 4-Cyano-2,3,5,6-tetrachlorophenyl butanoate

Systematic Name

  • Butanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester

Registry Numbers

CAS Registry Number

  • 67205-54-3

System Generated Number

  • 0067205543

Structure Descriptors

InChI

1S/C11H7Cl4NO2/c1-2-3-6(17)18-11-9(14)7(12)5(4-16)8(13)10(11)15/h2-3H2,1H3

InChIKey

FCZWYAFKVWAXKA-UHFFFAOYSA-N

Smiles

CCCC(=O)Oc1c(c(c(c(c1Cl)Cl)C#N)Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 906, 1978.