Titanyl Phthalocyanine(purifiedbysublimation)

Base Information

• Chemical Name: Titanyl Phthalocyanine(purifiedbysublimation)
• CAS No.: 26201-32-1
• Molecular Formula: C32H16N8OTi
• Molecular Weight: 576.412
• Hs Code.: 29339900
• Mol file: 26201-32-1.mol

Synonyms:CS-0168877;Titanyl Phthalocyanine(purifiedbysublimation)

Chemical Property of Titanyl Phthalocyanine(purifiedbysublimation)

Chemical Property:

• Melting Point: 395.1 °C (dec.)(lit.)
• PSA: 101.09000
• LogP: 1.34560
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility.: Chlorobenzene [7]
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 576.0926478
• Heavy Atom Count: 42
• Complexity: 1010

Purity/Quality:

98% ^*data from raw suppliers

Titanyl Phthalocyanine (purified by sublimation) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.O=[Ti+2]
• Description: Titanyl phthalocyanine (TiOPc), the family member of highly photosensitive phthalocyanine compounds, is one of the most successful leading materials used in the photocopying industry. Among various phthalocyanine semiconductors, oxotitanium phthalocyanine in the crystal form of phase-Y (Y-TiOPc) has attracted particular attention due to its high photosensitivity to NIR light.?The quantum efficiency of Y-form TiOPc for photo carrier generation is reported to be almost 100% in high electric fields[2].
• Uses: Sensitizer for electrophotography.

Technology Process of Titanyl Phthalocyanine(purifiedbysublimation)

There total 32 articles about Titanyl Phthalocyanine(purifiedbysublimation) which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 97.0%

titanium(IV) chloride phthalocyaninate (1208497-30-6,16903-42-7) + water (7732-18-5) → oxotitanium(IV) phthalocyanine (26201-32-1)

Guidance literature:

In pyridine; Ti-complex was boiled in aq. pyridine for 2 h, cooled; filtered, washed with water, dried in vacuo at 100°C; elem. anal.;

Reference yield: 86.2%

titanium (IV) butoxide (5593-70-4) + urea (57-13-6) + phthalonitrile (91-15-6) → oxo(phthalocyaninato)titanium(IV) (26201-32-1)

Guidance literature:

In further solvent(s); byproducts: NH3, 1-octyl carbamate; N2 atmosphere; stirring alkoxide, urea and DCNB (150°C., 6 h, in 1-octanol); addn. of MeOH, refluxing (30 min, crystn.), filtration, washing (toluene, MeOH, H2O), drying (100°C, 1 Torr, 3 - 6 h); elem. anal.;

DOI:10.1246/bcsj.68.1001

Reference yield: 84.3%

→ oxotitanium(IV) phthalocyanine (26201-32-1)

Guidance literature:

In tetrahydrofuran; water; at 25 ℃; for 15 - 18h; Purification / work up;

upstream raw materials:

phthalonitrile

isoindole-1,3-diylidenediamine

dichlorotitanium phthalocyanine

water

Downstream raw materials:

(N,N'-di(p-tolyl)ureato-κ2N,N')phthalocyaninatotitanium(IV)

(N,N'-dimesitylureato-κ2N,N')phthalocyaninatotitanium(IV)

(2,6-diisopropylphenylimido)phthalocyaninatotitanium(IV)

Refernces

• 1、 -. "The metal phthalocyanine compound crystal and its manufacturing method, using the electrophotographic photosensitive member, method, Image forming device, and Image forming apparatus and process cartridge for". Paragraph 0233. . Retrieved 2017/12/27.
• 2、 -. "Titanyl phthalocyanine with improved milling properties". Page/Page column 11. . Retrieved 2012/07/13.