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Substance Name: Guanidine, benzyl-, hemisulfate
RN: 2551-73-7
InChIKey: XTNHCMPWHJGJIM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H11-N3.1/2H2-O4-S

Molecular Weight

  • 247.274
 
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Names and Synonyms

Synonyms

  • 1-Benzylguanidine hemisulfate
  • Guanidine, benzyl-, hemisulfate
  • NSC 8968

Systematic Names

  • Guanidine, (phenylmethyl)-, sulfate (2:1) (9CI)
  • Guanidine, benzyl-, hemisulfate

Registry Numbers

CAS Registry Number

  • 2551-73-7

Related Registry Number

  • 2211-57-6 (Parent)

System Generated Number

  • 0002551737

Molecular Formulas

Molecular Formula

  • C8-H11-N3.1/2H2-O4-S

Molecular Formula Fragments

  • C8-H11-N3
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C8H11N3.H2O4S/c9-8(10)11-6-7-4-2-1-3-5-7;1-5(2,3)4/h1-5H,6H2,(H4,9,10,11);(H2,1,2,3,4)

InChIKey

XTNHCMPWHJGJIM-UHFFFAOYSA-N

Smiles

S(=O)([O-])(O)=O.c1(CNC(=N)[NH2+])ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 125mg/kg (125mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 22, 1966.