Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,8-Octanedione, 2,7-bis(4-morpholinylmethyl)-1,8-bis(4-(pentyloxy)phenyl)-, dihydrochloride
RN: 138371-25-2
InChIKey: OBUXEUKBQLDBDG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C40-H60-N2-O6.2Cl-H

Molecular Weight

  • 737.8438
 
* 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

Synonym

  • 2,7-Bis(4-morpholinylmethyl)-1,8-bis(4-(pentyloxy)phenyl)-1,8-octanedione dihydrochloride

Systematic Name

  • 1,8-Octanedione, 2,7-bis(4-morpholinylmethyl)-1,8-bis(4-(pentyloxy)phenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 138371-25-2

System Generated Number

  • 0138371252

Molecular Formulas

Molecular Formula

  • C40-H60-N2-O6.2Cl-H

Molecular Formula Fragments

  • C40-H60-N2-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C40H60N2O6.2ClH/c1-3-5-9-25-47-37-17-13-33(14-18-37)39(43)35(31-41-21-27-45-28-22-41)11-7-8-12-36(32-42-23-29-46-30-24-42)40(44)34-15-19-38(20-16-34)48-26-10-6-4-2;;/h13-20,35-36H,3-12,21-32H2,1-2H3;2*1H

InChIKey

OBUXEUKBQLDBDG-UHFFFAOYSA-N

Smiles

CCCCCOc1ccc(cc1)C(=O)C(CCCCC(CN2CCOCC2)C(=O)c3ccc(cc3)OCCCCC)CN4CCOCC4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LDLo intraperitoneal 100mg/kg (100mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 775, 1991.