1381962-66-8

Basic information

• Product Name: C₁₈H₁₃NO₄P₂Se₂
• Synonyms: C₁₈H₁₃NO₄P₂Se₂
• CAS NO: 1381962-66-8
• Molecular Weight: 527.173
• Mol File: 1381962-66-8.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: C₁₈H₁₃NO₄P₂Se₂(CAS DataBase Reference)
• NIST Chemistry Reference: C₁₈H₁₃NO₄P₂Se₂(1381962-66-8)
• EPA Substance Registry System: C₁₈H₁₃NO₄P₂Se₂(1381962-66-8)

Safety Data

• Hazardous Substances Data: 1381962-66-8(Hazardous Substances Data)

Upstream product

• 62-53-3 aniline 
• 10154-54-8 Brenzcatechylphosphorigsaureester-anilid 
• 1381962-63-5 2-phenylamino-2-seleno-1,3,2-benzodioxaphospholane 
• 1641-40-3 pyrocatechol phosphorochloridite 

Relevant articles and documents

Theoretical and structural studies on mechanism of the Stec reaction

The mechanism of the Stec reaction between phosphoroselenanilidate or phosphonoanilidate and CS2, activated by strong bases, has been studied computationally, using DFT methods, and experimentally, by low temperature 31P NMR spectroscopy. From molecular calculations, the reaction pathway of the reaction has been revealed with several transition states and intermediates, including a low energy spirocyclic pentacoordinate transition state and acyclic tetracoordinate intermediates, which eventually were correlated with short living molecules detected by NMR spectroscopy.