Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Propanenitrile, 3-(butylphenylamino)-, sulfate (2:1)
RN: 63589-14-0
InChIKey: NHEDRLYKVGFJPZ-UHFFFAOYSA-N

Molecular Formula

  • C13-H18-N2.1/2H2-O4-S

Molecular Weight

  • 502.676
 
* 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

  • Propanenitrile, 3-(butylphenylamino)-, sulfate (2:1)

Registry Numbers

CAS Registry Number

  • 63589-14-0

System Generated Number

  • 0063589140

Molecular Formulas

Molecular Formula

  • C13-H18-N2.1/2H2-O4-S

Molecular Formula Fragments

  • C13-H18-N2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C13H18N2.H2O4S/c2*1-2-3-11-15(12-7-10-14)13-8-5-4-6-9-13;1-5(2,3)4/h2*4-6,8-9H,2-3,7,11-12H2,1H3;(H2,1,2,3,4)

InChIKey

NHEDRLYKVGFJPZ-UHFFFAOYSA-N

Smiles

N#CCCN(CCCC)c1ccccc1.S(=O)(=O)(O)O.N#CCCN(CCCC)c1ccccc1