86407-57-0

Basic information

• Product Name: titanium(4+) chloride 2-aminobenzenethiolate dicyclopenta-2,4-dienide
• CAS NO: 86407-57-0
• Molecular Formula: C₁₆H₁₆ClNSTi
• Molecular Weight: 337.6899
• Mol File: 86407-57-0.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 234.9°C at 760 mmHg
• Flash Point: 79.4°C
• Vapor Pressure: 0.0517mmHg at 25°C
• CAS DataBase Reference: titanium(4+) chloride 2-aminobenzenethiolate dicyclopenta-2,4-dienide(CAS DataBase Reference)
• NIST Chemistry Reference: titanium(4+) chloride 2-aminobenzenethiolate dicyclopenta-2,4-dienide(86407-57-0)
• EPA Substance Registry System: titanium(4+) chloride 2-aminobenzenethiolate dicyclopenta-2,4-dienide(86407-57-0)

Safety Data

• Hazardous Substances Data: 86407-57-0(Hazardous Substances Data)

Upstream product

• 1271-19-8 bis(cyclopentadienyl)titanium dichloride 
• 52380-58-2 sodium 2-aminothiophenol 

Relevant articles and documents

NEUE TITANOCEN-DERIVATE MIT AMINOTHIOPHENOLAT-LIGANDEN

Titanocene dichloride (Cp2TiCl2; Cp = η5-C5H5) reacts with the alkali aminothiophenolates NaSC6H4NH2-o or LiSC6H4NH2-p in tetrahydrofuran or benzene at room temperature.According to the applied stoichiometry, one or both of the chloride ligands are substituted, and the mono- or bis(aminothiophenolato) complexes Cp2TiCl(SC6H4NH2-o) (Ia), Cp2TiCl(SC6H4NH2-p) (Ib), Cp2Ti(SC6H4NH2-o)2 (IIa), or Cp2Ti(SC6H4NH2-p)2 (IIb) are formed.Analogously, from Cp2Ti(Cl)CH3 Cp2TiCH3(SC6H4NH2-o) (IIIa) or Cp2TiCH3(SC6H4NH2-p) (IIIb) are obtained.IIb, which was isolated as a mixturewith Ib, can be prepared in a pure state from Cp2TiCl2 and p-aminothiophenol in ether with triethylamine as supporting base.All substances were investigated by IR, 1H NMR and mass spectrometry.Fragmentation diagrams, based on the detection of metastable decays in the mass spectrometer, were established.