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Substance Name: Phosphonic acid, (4,5-dihydro-3-propyl-5-isoxazolyl)-, diammonium salt
RN: 125674-63-7
InChIKey: XTYSBWNVQDNOND-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H12-N-O4-P.2H3-N

Molecular Weight

  • 227.1992
 
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Names and Synonyms

Synonyms

  • (3-Propyl-2-isoxazolin-5-yl)phosphonic acid diammonium salt
  • Diammonium (4,5-dihydro-3-propyl-5-isoxazolyl)phosphonate

Systematic Name

  • Phosphonic acid, (4,5-dihydro-3-propyl-5-isoxazolyl)-, diammonium salt

Registry Numbers

CAS Registry Number

  • 125674-63-7

System Generated Number

  • 0125674637

Molecular Formulas

Molecular Formula

  • C6-H12-N-O4-P.2H3-N

Molecular Formula Fragments

  • C6-H12-N-O4-P
  • COMPONENT
  • H3-N

Structure Descriptors

InChI

1S/C6H12NO4P.2H3N/c1-2-3-5-4-6(11-7-5)12(8,9)10;;/h6H,2-4H2,1H3,(H2,8,9,10);2*1H3

InChIKey

XTYSBWNVQDNOND-UHFFFAOYSA-N

Smiles

CCCC1=NOC(C1)P(=O)([O-])[O-].[NH4+].[NH4+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 200mg/kg (200mg/kg)   United States Patent Document. Vol. #5006515,