Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Thiocyanic acid, 3-fluoropropyl ester
RN: 408-00-4
InChIKey: BQNDVYLVJFLZRV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C4-H6-F-N-S

Molecular Weight

  • 119.162
 
* 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-Fluoropropyl thiocyanate
  • 4-03-00-00329 (Beilstein Handbook Reference)
  • BRN 1746162

Systematic Name

  • Thiocyanic acid, 3-fluoropropyl ester

Registry Numbers

CAS Registry Number

  • 408-00-4

System Generated Number

  • 0000408004

Structure Descriptors

InChI

1S/C4H6FNS/c5-2-1-3-7-4-6/h1-3H2

InChIKey

BQNDVYLVJFLZRV-UHFFFAOYSA-N

Smiles

C(#N)SCCCF

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 18mg/kg (18mg/kg)   Journal of the American Chemical Society. Vol. 78, Pg. 3843, 1956.
mouse LD50 subcutaneous 18mg/kg (18mg/kg)   Compilation of LD50 Values of New Drugs.