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Copper(Ii) Bromide
CAS: 7789-45-9 | Br2Cu
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7789-45-9
Molecular Formula:
Br2Cu
Molecular Mass:
223.35 g/mol
Names and Synonyms:
Copper(Ii) Bromide
Copper bromide (CuBr2)
Cupric bromide
Copper(II) bromide
Copper dibromide
Identifiers:
SMILES:
[Br-].[Br-].[Cu+2]
InChI:
InChI=1S/2BrH.Cu/h2*1H;/q;;+2/p-2
Key Properties
Boiling Point
900 °C
CAS Common Chemistry
Melting Point
498 °C
CAS Common Chemistry
Density
4.71 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 223.35 g/mol | CAS Common Chemistry |
| 223.35399999999998 g/mol | RDKit | |
| 220.7662717 g/mol | RDKit | |
| Density | 4.71 g/cm³ | CAS Common Chemistry |
| 4.710 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Copper(II)_bromide | CAS Common Chemistry |
| Boiling Point | 900 °C | CAS Common Chemistry |
| Canonical SMILES | Br[Cu]Br | CAS Common Chemistry |
| InChI | InChI=1S/2BrH.Cu/h2*1H;/q;;+2/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=QTMDXZNDVAMKGV-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 498 °C | CAS Common Chemistry |
| Name | Copper bromide (CuBr2) | CAS Common Chemistry |
| Copper(II) bromide | CAS Common Chemistry | |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -5.9945 | RDKit |
| Molar Refractivity | 0.0 | RDKit |
