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Substance Name: Guanidine, (2-chlorobenzyl)-, semisulfate
RN: 3458-33-1
InChIKey: NLIYYPZUVJVOJK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H10-Cl-N3.1/2H2-O4-S

Molecular Weight

  • 465.36
 
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Names and Synonyms

Synonym

  • 1-(2-Chlorobenzyl)guanidine semesulfate

Systematic Name

  • Guanidine, (2-chlorobenzyl)-, semisulfate

Registry Numbers

CAS Registry Number

  • 3458-33-1

System Generated Number

  • 0003458331

Molecular Formulas

Molecular Formula

  • C8-H10-Cl-N3.1/2H2-O4-S

Molecular Formula Fragments

  • C8-H10-Cl-N3
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C8H10ClN3.H2O4S/c2*9-7-4-2-1-3-6(7)5-12-8(10)11;1-5(2,3)4/h2*1-4H,5H2,(H4,10,11,12);(H2,1,2,3,4)

InChIKey

NLIYYPZUVJVOJK-UHFFFAOYSA-N

Smiles

N(C(N)=N)Cc1c(cccc1)Cl.S(=O)(=O)(O)O.N(C(N)=N)Cc1c(cccc1)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 375mg/kg (375mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 22, 1966.