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About This Item
Empirical Formula (Hill Notation):
Cl4Ti
CAS Number:
Molecular Weight:
189.68
UNSPSC Code:
12352302
EC Index Number:
231-441-9
NACRES:
NA.22
MDL number:
Grade:
synthesis grade
Form:
liquid
grade
synthesis grade
Quality Level
vapor pressure
12 hPa ( 20 °C)
form
liquid
potency
3160 mg/kg LD50, skin (Rabbit)
bp
136 °C/1013 hPa
mp
-24 °C
density
1.728 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
[Ti+4].[Cl-].[Cl-].[Cl-].[Cl-]
InChI
1S/4ClH.Ti/h4*1H;/q;;;;+4/p-4
InChI key
XJDNKRIXUMDJCW-UHFFFAOYSA-J
Application
Titanium(IV) chloride can be used as a Lewis acid catalyst:
- In the ortho acylation of aryl alcohols to synthesize corresponding ortho C-acylated products.
- To synthesize various chlorinated compounds via Baylis−Hillman reaction reactions of aryl aldehydes with methyl vinyl ketone in the presence of Lewis base.
- To prepare 3,4-dihydropyrimidin-2(1H)-ones and thiones by Biginelli condensation reaction of aldehyde, 1,3-dicarbonyl compound, and urea or thiourea.
- In the hydrodefluorination reaction in the presence of triethylsilane as the reducing agent.
Analysis Note
Assay (argentometric): ≥ 97.0 %
Identity (ICP-OES): passes test
Identity (ICP-OES): passes test
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hcodes
Storage Class
6.1B - Non-combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
signalword
Danger
Hazard Classifications
Acute Tox. 1 Inhalation - Eye Dam. 1 - Skin Corr. 1B - STOT SE 3
target_organs
Respiratory system
supp_hazards
wgk
WGK 1
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
危险化学品
This item has
Certificates of Analysis (COA)
Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.
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Find documentation for the products that you have recently purchased in the Document Library.
Transformation of Trifluorotoluenes Triggered by Titanium (IV) Chloride-Catalyzed Hydrodefluorination using Hydrosilanes
Yamada T, et al.
Advanced Synthesis & Catalysis, 358(1), 62-66 (2016)
Transformation of Trifluorotoluenes Triggered by Titanium (IV) Chloride-Catalyzed Hydrodefluorination using Hydrosilanes
Yamada T, et al.
advanced synthesis and catalysis, 358(1), 62-66 (2016)
Titanium (IV) chloride-mediated ortho-acylation of phenols and naphthols
Bensari A and Zaveri NT
Synthesis, 2003(02), 0267-0271 (2003)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 8123820100 | 04022536404028 |
| 8123821000 | 04022536404035 |

