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Substance Name: 1,8-Octanedithiol
RN: 1191-62-4
UNII: KH3W3161HS
InChIKey: PGTWZHXOSWQKCY-UHFFFAOYSA-N

Molecular Formula

  • C8-H18-S2

Molecular Weight

  • 178.362
 
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Names and Synonyms

Name of Substance

  • 1,8-Octanedithiol

Synonyms

  • 1,8-Dimercaptooctane
  • 1,8-Octamethylenedithiol
  • 1,8-Octanedithiol
  • 4-01-00-02592 (Beilstein Handbook Reference)
  • BRN 1735431
  • EINECS 214-738-8
  • FEMA No. 3514
  • Octamethylene dimercaptan
  • UNII-KH3W3161HS

Systematic Name

  • Octane-1,8-dithiol

Superlist Name

  • 1,8-Octanedithiol

Registry Numbers

CAS Registry Number

  • 1191-62-4

FDA UNII

  • KH3W3161HS

System Generated Number

  • 0001191624

Structure Descriptors

InChI

1S/C8H18S2/c9-7-5-3-1-2-4-6-8-10/h9-10H,1-8H2

InChIKey

PGTWZHXOSWQKCY-UHFFFAOYSA-N

Smiles

C(CCCCS)CCCS

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 882mg/kg (882mg/kg)   Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980.