65801-07-2

Basic information

• Product Name: tetra-n-butylammonium phenol-phenolate
• CAS NO: 65801-07-2
• Molecular Weight: 429.687
• Mol File: 65801-07-2.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: tetra-n-butylammonium phenol-phenolate(CAS DataBase Reference)
• NIST Chemistry Reference: tetra-n-butylammonium phenol-phenolate(65801-07-2)
• EPA Substance Registry System: tetra-n-butylammonium phenol-phenolate(65801-07-2)

Safety Data

• Hazardous Substances Data: 65801-07-2(Hazardous Substances Data)

Upstream product

• 2052-49-5 tetra(n-butyl)ammonium hydroxide 
• 108-95-2 phenol 
• 1643-19-2 tetrabutylammomium bromide 
• 1392488-19-5 C₆H₅O^(1-)*C₆H₆O*C₈H₂₀N⁽¹⁺⁾ 
• 1392488-18-4 C₄H₁₂N⁽¹⁺⁾*C₆H₅O^(1-)*C₆H₆O 
• 1392488-23-1 C₆H₅O^(1-)*C₆H₆O*C₃₂H₆₈N⁽¹⁺⁾ 
• 1392488-21-9 C₆H₅O^(1-)*C₆H₆O*C₂₄H₅₂N⁽¹⁺⁾ 

Downstream Products

• 946-80-5 (benzyloxy)benzene 
• 1643-19-2 tetrabutylammomium bromide 
• 108-95-2 phenol 
• 1392488-20-8 C₆H₅O^(1-)*C₆H₆O*C₁₂H₂₈N⁽¹⁺⁾ 
• 1392488-21-9 C₆H₅O^(1-)*C₆H₆O*C₂₄H₅₂N⁽¹⁺⁾ 
• 1392488-23-1 C₆H₅O^(1-)*C₆H₆O*C₃₂H₆₈N⁽¹⁺⁾ 
• 1392488-19-5 C₆H₅O^(1-)*C₆H₆O*C₈H₂₀N⁽¹⁺⁾ 
• 1126-79-0 n-butyl phenyl ether 

Relevant articles and documents

Cation-anion CH?O- interactions in the metal-free phenolate, tetra-n-butylammonium phenol-phenolate

Deprotonation of phenol by tetra-n-butylammonium hydroxide and subsequent removal of water by P2O5 results in quantitative formation of tetra-n-butylammonium phenol-phenolate. The compound crystallizes as an ion pair, with the solute phenol molecule intimately attached to the phenolate anion by an O-H?O- hydrogen bond (O?O 2.471(5)?). A short contact between one α-C atom of the tetra-n-butylammonium cation and the phenolate O atom indicates that the ion pair interaction is strengthened by an additional C-H?O- hydrogen-bond, despite the attached phenol.