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Substance Name: Pentachlorothiophenol
RN: 133-49-3
UNII: 92A1Z48VJB
InChIKey: LLMLGZUZTFMXSA-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C6-H-Cl5-S

Molecular Weight

  • 282.4049
 
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Names and Synonyms

Name of Substance

  • Pentachlorothiophenol

Synonyms

  • 4-06-00-01642 (Beilstein Handbook Reference)
  • AI3-23118
  • Benzenethiol, pentachloro-
  • BRN 1108638
  • EINECS 205-107-8
  • HSDB 6124
  • NSC 5578
  • PCTP
  • Pentachloro-benzenethiol
  • Pentachlorothiophenol
  • Pentachlorthiofenol
  • Pentachlorthiofenol [Czech]
  • RPA 6
  • UNII-92A1Z48VJB
  • USAF B-51

Systematic Names

  • Benzenethiol, 2,3,4,5,6-pentachloro-
  • Benzenethiol, pentachloro-
  • Pentachlorobenzenethiol

Superlist Name

  • Pentachlorothiophenol

Registry Numbers

CAS Registry Number

  • 133-49-3

FDA UNII

  • 92A1Z48VJB

System Generated Number

  • 0000133493

Structure Descriptors

InChI

1S/C6HCl5S/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H

InChIKey

LLMLGZUZTFMXSA-UHFFFAOYSA-N

Smiles

c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD277-689,