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13777-25-8

Basic Information
CAS No.: 13777-25-8
Name: ZIRCONIUM BROMIDE
Article Data: 40
Molecular Structure:
Molecular Structure of 13777-25-8 (ZIRCONIUM BROMIDE)
Formula: Br4Zr
Molecular Weight: 410.84
Synonyms: Zirconiumbromide (ZrBr4) (6CI,8CI);NSC 151954;Zirconium bromide;Zirconiumtetrabromide;
EINECS: 237-417-4
Density: 4.201 g/cm3
Melting Point: 450°C
Boiling Point: 360°C (estimate)
Solubility: Soluble in water.
Hazard Symbols: CorrosiveC
Risk Codes: 20/21/22-34
Safety: 22-26-27-36/37/39-45
Transport Information: UN 3260
PSA: 0.00000
LogP: 3.38240
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Specification

The Zirconium bromide(Br4Zr), (T-4)-, with CAS registry number 13777-25-8, has the systematic name of zirconium(4+) tetrabromide. Besides this, it is also called Zirconium bromide. And the chemical formula of this chemical is Br4Zr. What's more, its EINECS is 237-417-4.

Physical properties of Zirconium bromide(Br4Zr), (T-4)-: (1)ACD/LogP: 0.00; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 0 Å2; (7)Enthalpy of Vaporization: 19.92 kJ/mol; (8)Vapour Pressure: 20200 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Zirconium bromide(Br4Zr), (T-4)- is harmful by inhalation, in contact with skin and if swallowed. And this chemical may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: Br[Zr](Br)(Br)Br
(2)InChI: InChI=1/4BrH.Zr/h4*1H;/q;;;;+4/p-4
(3)InChIKey: LSWWNKUULMMMIL-XBHQNQODAM
(4)Std. InChI: InChI=1S/4BrH.Zr/h4*1H;/q;;;;+4/p-4
(5)Std. InChIKey: LSWWNKUULMMMIL-UHFFFAOYSA-J