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Substance Name: Butanoic acid, pentachlorophenyl ester (9CI)
RN: 7476-90-6
InChIKey: KCXVYDVAQYFMHH-UHFFFAOYSA-N

Molecular Formula

  • C10-H7-Cl5-O2

Molecular Weight

  • 336.428
 
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Names and Synonyms

Synonym

  • Pentachlorophenyl butyrate

Systematic Names

  • Butanoic acid, pentachlorophenyl ester (9CI)
  • Butyric acid, pentachlorophenyl ester

Registry Numbers

CAS Registry Number

  • 7476-90-6

System Generated Number

  • 0007476906

Structure Descriptors

InChI

1S/C10H7Cl5O2/c1-2-3-4(16)17-10-8(14)6(12)5(11)7(13)9(10)15/h2-3H2,1H3

InChIKey

KCXVYDVAQYFMHH-UHFFFAOYSA-N

Smiles

c1(c(c(c(Cl)c(c1Cl)Cl)Cl)Cl)OC(=O)CCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 8, Pg. 101, 1956.