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2D Structure
Also known as: Calcium;dibromide, Calcium bromide [jan], Calcium bromide, ultra dry , 99.978% (metals basis), Calcium bromide (jan), Calciumbromid, Calcium bromatum
Molecular Formula
Br2Ca
Molecular Weight
199.89  g/mol
InChI Key
WGEFECGEFUFIQW-UHFFFAOYSA-L

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
calcium;dibromide
2.1.2 InChI
InChI=1S/2BrH.Ca/h2*1H;/q;;+2/p-2
2.1.3 InChI Key
WGEFECGEFUFIQW-UHFFFAOYSA-L
2.1.4 Canonical SMILES
[Ca+2].[Br-].[Br-]
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Calcium;dibromide

2. Calcium Bromide [jan]

3. Calcium Bromide, Ultra Dry , 99.978% (metals Basis)

4. Calcium Bromide (jan)

5. Calciumbromid

6. Calcium Bromatum

7. Calcium Bromide Solution

8. Calcium Bromide Anhydrous

9. Hydrobromic Acid Calcium Salt

10. Einecs 232-164-6

11. Brocal (tn)

12. Ca Br2

13. Unii-87cny2eebh

14. Dsstox_cid_24577

15. Dsstox_rid_80326

16. Dsstox_gsid_44577

17. Calcium Bromide,hydrate (9ci)

18. Hsdb 8493

19. Bcp21634

20. Tox21_301859

21. Br1142

22. Akos015902774

23. Ncgc00255890-01

24. Cas-7789-41-5

25. D01723

26. Ec 232-164-6

27. Calcium Bromide, Anhydrous, Beads, -10 Mesh, 99.98% Trace Metals Basis

2.2.2 Other Synonyms

1. Calcium Dibromide

2. 7789-41-5

3. Calcium Bromide

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 199.89 g/mol
Molecular Formula Br2Ca
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass199.79722 g/mol
Monoisotopic Mass197.79927 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count3
Formal Charge0
Complexity2.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3