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Substance Name: Morpholinium, 4-(5-morpholino-2,4-pentadienylidene)-, chloride, dihydrate
RN: 64038-83-1
InChIKey: XDPMKIBCTGOLAF-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H21-N2-O2.Cl.2H2-O

Molecular Weight

  • 308.803
 
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Names and Synonyms

Synonym

  • 4-(5-Morpholino-2,4-pentadievylidene)morpholinium chloride, hydrate

Systematic Name

  • Morpholinium, 4-(5-morpholino-2,4-pentadienylidene)-, chloride, dihydrate

Registry Numbers

CAS Registry Number

  • 64038-83-1

System Generated Number

  • 0064038831

Molecular Formulas

Molecular Formula

  • C13-H21-N2-O2.Cl.2H2-O

Molecular Formula Fragments

  • C13-H21-N2-O2
  • Cl
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C13H21N2O2.ClH.2H2O/c1(2-4-14-6-10-16-11-7-14)3-5-15-8-12-17-13-9-15;;;/h1-5H,6-13H2;1H;2*1H2/q+1;;;/p-1

InChIKey

XDPMKIBCTGOLAF-UHFFFAOYSA-M

Smiles

[N+]1(=C\C=C\C=C\N2CCOCC2)\CCOCC1.[ClH-].O.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 806, 1969.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 806, 1969.