Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Heptanedinitrile, 4-(2-cyanoethyl)-4-p-toluoyl-
RN: 7461-85-0
InChIKey: FEGPPHGAJSUBAE-UHFFFAOYSA-N

Molecular Formula

  • C18-H19-N3-O

Molecular Weight

  • 293.368
 
* 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

  • 3-10-00-04132 (Beilstein Handbook Reference)
  • 4-(2-Cyanoethyl)-4-p-toluoylheptanedinitrile
  • BRN 3386692
  • Heptanedinitrile, 4-(2-cyanoethyl)-4-(p-toluoyl)-
  • NSC 404116

Systematic Names

  • Heptanedinitrile, 4-(2-cyanoethyl)-4-(4-methylbenzoyl)- (9CI)
  • Heptanedinitrile, 4-(2-cyanoethyl)-4-p-toluoyl-

Registry Numbers

CAS Registry Number

  • 7461-85-0

System Generated Number

  • 0007461850

Structure Descriptors

InChI

1S/C18H19N3O/c1-15-5-7-16(8-6-15)17(22)18(9-2-12-19,10-3-13-20)11-4-14-21/h5-8H,2-4,9-11H2,1H3

InChIKey

FEGPPHGAJSUBAE-UHFFFAOYSA-N

Smiles

C(C(c1ccc(C)cc1)=O)(CCC#N)(CCC#N)CCC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 9, Pg. 130, 1957.