Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Propanethiol, 3-((5-cyclooctyloxypentyl)amino)-, hydrogen sulfate (ester)
RN: 38914-42-0
InChIKey: SWNNISFWMQYKEP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H33-N-O4-S2

Molecular Weight

  • 367.5717
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 3-((5-Cyclooctyloxypentyl)amino)propanethiol, hydrogen sulfate (ester)
  • BRN 2473482

Systematic Name

  • Propanethiol, 3-((5-cyclooctyloxypentyl)amino)-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 38914-42-0

System Generated Number

  • 0038914420

Structure Descriptors

InChI

1S/C16H33NO4S2/c18-23(19,20)22-15-9-13-17-12-7-4-8-14-21-16-10-5-2-1-3-6-11-16/h16-17H,1-15H2,(H,18,19,20)

InChIKey

SWNNISFWMQYKEP-UHFFFAOYSA-N

Smiles

C1CCCC(CCC1)OCCCCCNCCCSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 110mg/kg (110mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 968, 1972.