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Substance Name: Pseudourea, 2-amino-1-(phenylpropyl)-2-thio-, hydrogen sulfate
RN: 63680-54-6
InChIKey: SOQMOFNBWBVHAF-UHFFFAOYSA-N

Molecular Formula

  • C10-H15-N3-S.H2-O4-S

Molecular Weight

  • 307.393
 
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Names and Synonyms

Synonyms

  • 2-Amino-1-phenyl-propyl-isothiouronium sulfate
  • Pseudourea, 2-thio-, 2-amino-1-phenylpropyl-, sulfate
  • USAF B-112

Systematic Name

  • Pseudourea, 2-amino-1-(phenylpropyl)-2-thio-, hydrogen sulfate

Registry Numbers

CAS Registry Number

  • 63680-54-6

System Generated Number

  • 0063680546

Molecular Formulas

Molecular Formula

  • C10-H15-N3-S.H2-O4-S

Molecular Formula Fragments

  • C10-H15-N3-S
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C10H15N3S.H2O4S/c1-7(11)9(14-10(12)13)8-5-3-2-4-6-8;1-5(2,3)4/h2-7,9H,11H2,1H3,(H3,12,13);(H2,1,2,3,4)

InChIKey

SOQMOFNBWBVHAF-UHFFFAOYSA-N

Smiles

S(O)(=O)(O)=O.C(S[C@@H](c1ccccc1)[C@@H](N)C)(=N)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 5mg/kg (5mg/kg)   National Technical Information Service. Vol. AD277-689,