Zirconium oxychloride

Base Information

• Chemical Name: Zirconium oxychloride
• CAS No.: 25399-81-9
• Deprecated CAS: 12371-05-0,15169-54-7,22547-97-3,23395-03-1,31411-63-9,1033044-62-0,1133021-29-0,2112767-86-7,1033044-62-0,1133021-29-0,22547-97-3,23395-03-1,31411-63-9
• Molecular Formula: Cl₂OZr*8H₂O
• Molecular Weight: 322.252
• European Community (EC) Number: 231-717-9
• NSC Number: 115914
• UN Number: 1759
• DSSTox Substance ID: DTXSID9049823
• Wikipedia: Zirconyl chloride,Zirconyl_chloride
• Mol file: 25399-81-9.mol

Synonyms:zirconium chloride oxide;zirconium oxychloride;zirconium oxychloride octahydrate;zirconium oxydichloride

Chemical Property of Zirconium oxychloride

Chemical Property:

• Appearance/Colour: white crystalline powder
• Melting Point: 150 C (loss of water of crystallization)
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 17.07000
• Density: g/cm³
• LogP: 1.26020
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 177.852969
• Heavy Atom Count: 4
• Complexity: 6
• Transport DOT Label: Corrosive

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Chemical Classes: Metals -> Metals, Inorganic Compounds
• Canonical SMILES: O=[Zr].Cl.Cl

Technology Process of Zirconium oxychloride

There total 1 articles about Zirconium oxychloride 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:

hydrogenchloride (7647-01-0,15364-23-5) + zirconium(IV) carbonate → ziconium(IV) oxychloride octahydrate (13520-92-8,25399-81-9,15461-27-5)

Guidance literature:

In hydrogenchloride; byproducts: CO2; Zr(CO3)2 dissolved in concd. HCl, refluxed for 1 h; cooled, filtered, washed with cold concd. HCl, recrystd. from aq. HCl, air dried;

DOI:10.1021/ic50217a054

Reference yield: 86.0%

ziconium(IV) oxychloride octahydrate (13520-92-8,25399-81-9,15461-27-5) + 2,4,6-tris[4-(phosphonomethyl)phenyl]-1,3,5-triazine + water (7732-18-5) → Zr(H4ttbmp)2*10H2O

Guidance literature:

With hydrogen fluoride; In methanol; at 80 ℃; for 48h;

DOI:10.1039/c4cc06223j

Reference yield: 85.0%

ziconium(IV) oxychloride octahydrate (13520-92-8,25399-81-9,15461-27-5) + formic acid (64-18-6) + benzene-1,3,5-tricarboxylic acid (554-95-0) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → Zr6O4(12+)*2C9H3O6(3-)*6HO(1-)*2CH2O2*1.5C3H7NO*20H2O

Guidance literature:

at 130 ℃; for 0.48h;

DOI:10.1039/d0cc06134d

upstream raw materials:

hydrogenchloride

Downstream raw materials:

zirconium tetrahydroxide

Refernces