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Substance Name: Phosphonic acid, (1-amino-3-(diethoxyphosphinyl)propylidene)bis-, dihydrate
RN: 69549-53-7
InChIKey: VNRTZLGDHUVBBX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H20-N-O9-P3.2H2-O

Molecular Weight

  • 355.155
 
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Names and Synonyms

Synonyms

  • (1-Amino-3-(diethoxyphosphinyl)propylidene)bisphosphonic acid dihydrate
  • alpha-Amino-gamma-diethoxyphosphonopropylidene-alpha,alpha-diphosphoic acid dihydrate

Systematic Name

  • Phosphonic acid, (1-amino-3-(diethoxyphosphinyl)propylidene)bis-, dihydrate

Registry Numbers

CAS Registry Number

  • 69549-53-7

System Generated Number

  • 0069549537

Molecular Formulas

Molecular Formula

  • C7-H20-N-O9-P3.2H2-O

Molecular Formula Fragments

  • C7-H20-N-O9-P3
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C7H20NO9P3/c1-3-16-18(9,17-4-2)6-5-7(8,19(10,11)12)20(13,14)15/h3-6,8H2,1-2H3,(H2,10,11,12)(H2,13,14,15)

InChIKey

VNRTZLGDHUVBBX-UHFFFAOYSA-N

Smiles

CCOP(=O)(CCC(N)(P(=O)(O)O)P(=O)(O)O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 12(11), Pg. 35, 1978.