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Substance Name: Guanidine, 1-(3,4-diethoxybenzyl)-, sulfate (2:1)
RN: 21533-04-0
InChIKey: SQNJMJUIQBQMOY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H19-N3-O2.1/2H2-O4-S

Molecular Weight

  • 335.379
 
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Names and Synonyms

Synonym

  • 1-(3,4-Diethoxybenzyl)guanidine sulfate (2:1)

Systematic Name

  • Guanidine, 1-(3,4-diethoxybenzyl)-, sulfate (2:1)

Registry Numbers

CAS Registry Number

  • 21533-04-0

System Generated Number

  • 0021533040

Molecular Formulas

Molecular Formula

  • C12-H19-N3-O2.1/2H2-O4-S

Molecular Formula Fragments

  • C12-H19-N3-O2
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C12H19N3O2.H2O4S/c1-3-16-10-6-5-9(8-15-12(13)14)7-11(10)17-4-2;1-5(2,3)4/h5-7H,3-4,8H2,1-2H3,(H4,13,14,15);(H2,1,2,3,4)

InChIKey

SQNJMJUIQBQMOY-UHFFFAOYSA-N

Smiles

c1(c(ccc(C[NH+]C(=N)[NH2+])c1)OCC)OCC.S(=O)(=O)([O-])[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 15mg/kg (15mg/kg)   Therapie. Vol. 23, Pg. 1221, 1968.