Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pseudourea, 2-propyl-2-thio-, p,p'-dipropylpyrophosphate (2:1)
RN: 37031-97-3
InChIKey: NIJUOQHRLQRNNJ-UHFFFAOYSA-N

Molecular Formula

  • C8-H22-N4-S2.C6-H16-O7-P2

Molecular Weight

  • 498.539
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2-Propyl-2-thiopseudourea p,p'-dipropylpyrophosphate (2:1)
  • p,p'-Dipropylpyrophosphate bis-S-propyl-isothiuronium

Systematic Name

  • Pseudourea, 2-propyl-2-thio-, p,p'-dipropylpyrophosphate (2:1)

Registry Numbers

CAS Registry Number

  • 37031-97-3

System Generated Number

  • 0037031973

Molecular Formulas

Molecular Formula

  • C8-H22-N4-S2.C6-H16-O7-P2

Molecular Formula Fragments

  • C6-H16-O7-P2
  • C8-H22-N4-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C6H16O7P2.2C4H10N2S/c1-3-5-11-14(7,8)13-15(9,10)12-6-4-2;2*1-2-3-7-4(5)6/h3-6H2,1-2H3,(H,7,8)(H,9,10);2*2-3H2,1H3,(H3,5,6)

InChIKey

NIJUOQHRLQRNNJ-UHFFFAOYSA-N

Smiles

C(N)(SCCC)=N.O([P@@](=O)(O)OCCC)[P@@](=O)(OCCC)O.C(N)(SCCC)=N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 510mg/kg (510mg/kg)   Russian Pharmacology and Toxicology Vol. 39, Pg. 66, 1976.