Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-ethyl-, di-p-toluenesulfonate
RN: 21595-62-0
InChIKey: QJPOLWZCPYBDCC-OCMVVAPRSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C38-H38-N6-O2.2C7-H7-O3-S

Molecular Weight

  • 953.1488
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Systematic Name

  • Pyridinium, 4,4'-(p-phenylenebis(acryloylimino-p-phenyleneimino))bis(1-ethyl-, di-p-toluenesulfonate

Superlist Names

  • Resin solution, flammable
  • Resin solution, flammable [UN1866] [Flammable liquid]
  • UN1866

Registry Numbers

CAS Registry Number

  • 21595-62-0

System Generated Number

  • 0021595620

Molecular Formulas

Molecular Formula

  • C38-H38-N6-O2.2C7-H7-O3-S

Molecular Formula Fragments

  • C38-H38-N6-O2
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C38H36N6O2.2C7H8O3S/c1-3-43-25-21-35(22-26-43)39-31-11-15-33(16-12-31)41-37(45)19-9-29-5-7-30(8-6-29)10-20-38(46)42-34-17-13-32(14-18-34)40-36-23-27-44(4-2)28-24-36;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-28H,3-4H2,1-2H3,(H2,41,42,45,46);2*2-5H,1H3,(H,8,9,10)/b19-9+,20-10+;;

InChIKey

QJPOLWZCPYBDCC-OCMVVAPRSA-N

Smiles

CC[n+]1ccc(cc1)Nc2ccc(cc2)NC(=O)/C=C/c3ccc(cc3)/C=C/C(=O)Nc4ccc(cc4)Nc5cc[n+](cc5)CC.Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 32mg/kg (32mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.