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Substance Name: Guanidine, 1-(2-(1,4-benzodioxan-6-yl)ethyl)-, oxalate (2:1)
RN: 17413-09-1
InChIKey: AQYCXQTYGPVESD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H15-N3-O2.1/2C2-H2-O4

Molecular Weight

  • 311.292
 
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Names and Synonyms

Synonyms

  • (Guanidino 2 ethyl) 6 benzodioxanne 1,4 hemioxalate
  • (Guanidino 2 ethyl) 6 benzodioxanne 1,4 hemioxalate [French]
  • 1-(2-(1,4-Benzodioxan-6-yl)ethyl)guanidine oxalate (2:1)

Systematic Name

  • Guanidine, 1-(2-(1,4-benzodioxan-6-yl)ethyl)-, oxalate (2:1)

Registry Numbers

CAS Registry Number

  • 17413-09-1

System Generated Number

  • 0017413091

Molecular Formulas

Molecular Formula

  • C11-H15-N3-O2.1/2C2-H2-O4

Molecular Formula Fragments

  • C11-H15-N3-O2
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C11H15N3O2.C2H2O4/c12-11(13)14-4-3-8-1-2-9-10(7-8)16-6-5-15-9;3-1(4)2(5)6/h1-2,7H,3-6H2,(H4,12,13,14);(H,3,4)(H,5,6)

InChIKey

AQYCXQTYGPVESD-UHFFFAOYSA-N

Smiles

c12c(ccc(CC[NH+]C(=N)[NH2+])c1)OCCO2.C(C(=O)[O-])(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 75mg/kg (75mg/kg)   Therapie. Vol. 23, Pg. 1221, 1968.