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zirconium chloride hydroxide structure
zirconium chloride hydroxide structure

zirconium chloride hydroxide

Iupac Name:zirconium(2+);chloride;hydroxide
CAS No.: 10119-31-0
Molecular Weight:390.55612
Modify Date.: 2023-12-24 05:10
Introduction: Pharmaceuticals, deodorants, precipitation ofacid dyes, water repellents for textiles. View more+
1. Names and Identifiers
1.1 Name
zirconium chloride hydroxide
1.2 Synonyms

Chloro(hydroxy)zirconium(II) Nickenol-371 zirconium chloride hydroxide Zirconium chloride hydroxide (Zr(OH)Cl) Zirconium chloride hydroxide (ZrCl(OH)) Zirconium hydrochloride Zirconium hydroxy chloride Zirconium hydroxychloride Zirconium(2+) chloride hydroxide (1:1:1)

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1.3 CAS No.
10119-31-0
1.4 CID
57346135
1.5 EINECS(EC#)
233-323-2
1.6 Molecular Formula
ClHOZr (isomer)
1.7 Inchi
InChI=1S/ClH.H2O.Zr/h1H;1H2;/q;;+2/p-2
1.8 InChIkey
BLKLTTCUAPDQEG-UHFFFAOYSA-L
1.9 Canonical Smiles
[OH-].[Cl-].[Zr+2]
1.10 Isomers Smiles
[OH-].[Cl-].[Zr+2]
2. Properties
2.1 Density
1.260
2.1 Boiling point
°Cat760mmHg
2.1 Flash Point
°C
2.1 PSA
46.12000
2.1 logP
-6.34560
2.1 Chemical Properties
Colorless or slightly amber liquid (aqueoussolution).Forms a soluble glass onevaporation, pH of solution 0.8, reacts with alkaliesto form hydrous zirconia; contains 20% zirconia.
3. Use and Manufacturing
3.1 Usage
Pharmaceuticals, deodorants, precipitation ofacid dyes, water repellents for textiles.
4. Safety and Handling
4.1 Safety Statements
A human skin irritant. When heated to decomposition it emits toxic fumes of Cl−. Used as an antiperspirant. See also ZIRCONIUM COMPOUNDS and CHLORIDES.
4.1 Packing Group
III
4.1 Hazard Class
8
4.1 RIDADR
1759
4.1 Safety Profile
A human skin irritant.When heated to decomposition it emitstoxic fumes of Cl-. Used as anantiperspirant. See also ZIRCONIUMCOMPOUNDS and CHLORIDES. zirconium chloride hydroxide Supplier
4.2 Report

Reported in EPA TSCA Inventory.

4.3 Safety

A human skin irritant. When heated to decomposition it emits toxic fumes of Cl. Used as an antiperspirant. See also ZIRCONIUM COMPOUNDS and CHLORIDES.

4.4 Specification

 Zirconium chloride hydroxide ,its CAS NO. is 10119-31-0,the synonyms is EINECS 233-323-2 ; Nickenol 371 ; Zirconium chlorohydrate ; Zirconium hydroxychloride ; Zirconyl hydroxychloride .

4.5 Toxicity
1.    

skn-hmn 45 mg/3D-I MOD

    85DKA8    Cutaneous Toxicity Drill, V.A. andP. Lazar, eds.,New York, NY.: Academic Press,1977,127.
5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

6. Other Information
6.0 Chemical Properties
Colorless or slightly amber liquid (aqueous solution).Forms a soluble glass on evaporation, pH of solution 0.8, reacts with alkalies to form hydrous zirconia; contains 20% zirconia.
6.1 Uses
Pharmaceuticals, deodorants, precipitation of acid dyes, water repellents for textiles.
6.2 Safety Profile
A human skin irritant. When heated to decomposition it emits toxic fumes of Cl-. Used as an antiperspirant. See also ZIRCONIUM COMPOUNDS and CHLORIDES.
7. Computational chemical data
  • Molecular Weight: 390.55612g/mol
  • Molecular Formula: ClHOZr
  • Compound Is Canonicalized: True
  • XLogP3-AA: null
  • Exact Mass: 141.876291
  • Monoisotopic Mass: 141.876291
  • Complexity: 0
  • Rotatable Bond Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Topological Polar Surface Area: 1
  • Heavy Atom Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count: 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 3
  • CACTVS Substructure Key Fingerprint: AAADcQAAIAAEAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
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