Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyrrolidinium, 1-(2-(1,3-dihydro-2-oxo-3,5,7-trimethyl-2H-azepin-1-yl)ethyl)-1,2,2,4-tetramethyl-, iodide
RN: 1676-51-3
InChIKey: DWBUQUUKZWIGIA-UHFFFAOYSA-M

Molecular Formula

  • C19-H33-N2-O.I

Molecular Weight

  • 432.383
 
* 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

  • Pyrrolidinium, 1-(2-(1,3-dihydro-2-oxo-3,5,7-trimethyl-2H-azepin-1-yl)ethyl)-1,2,2,4-tetramethyl-, iodide

Registry Numbers

CAS Registry Number

  • 1676-51-3

System Generated Number

  • 0001676513

Molecular Formulas

Molecular Formula

  • C19-H33-N2-O.I

Molecular Formula Fragments

  • C19-H33-N2-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C19H33N2O.HI/c1-14-10-16(3)18(22)20(17(4)11-14)8-9-21(7)13-15(2)12-19(21,5)6;/h10-11,15-16H,8-9,12-13H2,1-7H3;1H/q+1;/p-1

InChIKey

DWBUQUUKZWIGIA-UHFFFAOYSA-M

Smiles

[IH-].C1([N@@+](CCN2C([C@@H](C=C(C=C2C)C)C)=O)(C)C[C@@H](C1)C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 24mg/kg (24mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 771, 1963.