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Substance Name: Pseudourea, 2-(2-aminoethyl)-1-(o-biphenylyl)-2-thio-, hydrogen sulfate
RN: 63679-74-3
InChIKey: XNNXQKVEXMHAKS-UHFFFAOYSA-N

Molecular Formula

  • C15-H17-N3-S.H2-O4-S

Molecular Weight

  • 369.464
 
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Names and Synonyms

Synonyms

  • o-Biphenyl-2-(2-aminoethyl)-isothiouronium sulfate
  • USAF B-99

Systematic Name

  • Pseudourea, 2-(2-aminoethyl)-1-(o-biphenylyl)-2-thio-, hydrogen sulfate

Registry Numbers

CAS Registry Number

  • 63679-74-3

System Generated Number

  • 0063679743

Molecular Formulas

Molecular Formula

  • C15-H17-N3-S.H2-O4-S

Molecular Formula Fragments

  • C15-H17-N3-S
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C15H17N3S.H2O4S/c16-10-11-19-15(17)18-14-9-5-4-8-13(14)12-6-2-1-3-7-12;1-5(2,3)4/h1-9H,10-11,16H2,(H2,17,18);(H2,1,2,3,4)

InChIKey

XNNXQKVEXMHAKS-UHFFFAOYSA-N

Smiles

N(=C(/SCCN)N)\c1c(c2ccccc2)cccc1.S(=O)(=O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD277-689,