Oxolane; trichlorotitanium

Base Information

• Chemical Name: Oxolane; trichlorotitanium
• CAS No.: 18039-90-2
• Molecular Formula: C₁₂H₂₄Cl₃O₃Ti
• Molecular Weight: 370.56
• Hs Code.: 29310099
• European Community (EC) Number: 605-895-7
• DSSTox Substance ID: DTXSID60421979
• Mol file: 18039-90-2.mol

Synonyms:18039-90-2;oxolane;trichlorotitanium;trichlorotris(tetrahydrofuran)titanium(iii);Trichlorotris(THF)titanium;MFCD01631276;Titanium trichloride tris(tetrahydrofuran);DTXSID60421979;AKOS015914522;Titanium,trichlorotris(tetrahydrofuran)-;trichlorotris(tetrahydrofuran)tita-nium(iii);E78639

Chemical Property of Oxolane; trichlorotitanium

Chemical Property:

• Vapor Pressure: 152mmHg at 25°C
• Melting Point: 250 °C
• Boiling Point: 68.3°C at 760 mmHg
• PSA: 27.69000
• LogP: 4.45890
• Storage Temp.: Refrigerator (+4°C) + Flammables area
• Sensitive.: air sensitive, moisture sensitiv
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 369.027043
• Heavy Atom Count: 19
• Complexity: 30.8

Purity/Quality:

98%,99%, ^*data from raw suppliers

Trichlorotris(tetrahydrofuran)titanium(III), min. 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C-F,C,F
• Statements: 34-29-19-14-11
• Safety Statements: 8-45-36/37/39-26-16-27

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCOC1.C1CCOC1.C1CCOC1.Cl[Ti](Cl)Cl

Technology Process of Oxolane; trichlorotitanium

There total 16 articles about Oxolane; trichlorotitanium 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: 84.0%

(HTiCl(THF)0.5)n → titanium trichloride tris(tetrahydrofuran) (31168-87-3,18039-90-2) + 1,1,2,2-tetraphenylethylene (632-51-9)

Guidance literature:

With Ph₂CCl₂; In tetrahydrofuran; hexane; byproducts: H2; introducing a soln. of Ph2CCl2 in THF into a stirred suspn. of Ti-compd. in n-hexane under Ar, stirring at room temp. for 48 h, evolution of H2, addn. of THF, stirring for further 50 min, evolution of H2; addn. of aq. HCl, extn. of aq. layer with ether, monitoring by GC;

DOI:10.1016/0022-328X(94)80197-5

Reference yield: 82.0%

tetrahydrofuran (109-99-9,24979-97-3,77392-70-2) + 3TiCl3*AlCl3 → titanium trichloride tris(tetrahydrofuran) (31168-87-3,18039-90-2)

Guidance literature:

In tetrahydrofuran; toluene; under N2 atm. to slurry 3TiCl3*AlCl3 in toluene at -50°C THF was added and heated to reflux (70°C) for 14 h; react. mixt. was allowed to cool to room temp., ppt. was filtered and washed with hexane, dried at room temp. in vacuo; elem. anal.;

DOI:10.1021/om060486d

Reference yield: 74.0%

((2)HTiCl(THF)0.5)n → titanium trichloride tris(tetrahydrofuran) (31168-87-3,18039-90-2) + 1,1,2,2-tetraphenylethylene (632-51-9)

Guidance literature:

With (C₆H₅)2CCl₂; In tetrahydrofuran; byproducts: (2)H2; addn. of a soln. of Ph2CCl2 in THF to a stirred soln. of Ti-compd. in THF at 0°C, evolution of D2;

DOI:10.1016/0022-328X(94)80197-5

upstream raw materials:

tetrachlorobis(tetrahydrofuran)titanium(IV)

titanium

tetrahydrofuran

titanium(III) chloride

Downstream raw materials:

Ti(C₉H₁₀C₆H₄C₆H₅)2Cl₂

(Cl₃TiO(CH₃)2C₆H₂)2(C₄H₈O)4

[(η(5)-C5H4CH2CH2PPh2)2TiCl2]

Ti(η(5):η(1)-C5Me4SiMe2NC6H4(PPh2)-2)Cl2

Refernces

• 1、 Jones, Natalie A.,Liddle, Stephen T.,Wilson, Claire,Arnold, Polly L.. "Titanium(III) alkoxy-N-heterocyclic carbenes and a safe, low-cost route to TiCl3(THF)3". . p. 755 - 757. Retrieved 2008/10/09.
• 2、 Utko, Jozef,Przybylak, Szymon,Jerzykiewicz, Lucian B.,Mierzwicki, Krzysztof,Latajka, Zdzislaw,Sobota, Piotr. "The first structurally characterized nonorganometallic titanium(III) alkoxo-bridged dinuclear complexes". . p. 267 - 269. Retrieved 2008/10/08.