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Molecule
Selenium Tetrabromide
CAS: 7789-65-3 · Br4Se
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 7789-65-3
- Molecular Formula
- Br4Se
- Molecular Mass
- 398.58 g/mol
Identifiers
CAS Registry Number
7789-65-3
SMILES
Br[Se](Br)(Br)Br
InChI Key
VTQZBGAODFEJOW-UHFFFAOYSA-N
InChI
InChI=1S/Br4Se/c1-5(2,3)4
Names and Synonyms
- Selenium Tetrabromide Common Name
- Selenium bromide (SeBr4), (T-4)- Synonym
- Selenium bromide (SeBr4) Synonym
- Selenium tetrabromide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 398.58 g/mol | CAS Common Chemistry |
| 398.57599999999996 g/mol | RDKit | |
| 398.576 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Selenium_tetrabromide | CAS Common Chemistry |
| Canonical SMILES | Br[Se](Br)(Br)Br | CAS Common Chemistry |
| InChI | InChI=1S/Br4Se/c1-5(2,3)4 | CAS Common Chemistry |
| InChI Key | InChIKey=VTQZBGAODFEJOW-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 123 °C | CAS Common Chemistry |
| Name | Selenium bromide (SeBr4), (T-4)- | CAS Common Chemistry |
| Heavy Atom Count | 5 | 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 | 3.0016000000000003 | RDKit |
| 3.0016 | RDKit | |
| Molar Refractivity | 41.461999999999996 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 395.5898697 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 398.58 g/mol. Edit any field — others recompute live.
