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Chemistry

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Also known as: 38932-80-8, N,n,n,n-tetrabutylammonium tribromide, Tetrabutyl ammonium tribromide, Tetra-n-butylammonium tribromide, Mono(tetrabutylammonium) tribromide, Tbabr3
Molecular Formula
C16H36Br3N
Molecular Weight
482.2  g/mol
InChI Key
XXSLZJZUSYNITM-UHFFFAOYSA-N

Tetrabutylammonium tribromide
1 2D Structure

Tetrabutylammonium tribromide

2 Identification
2.1 Computed Descriptors
2.1.1 InChI
InChI=1S/C16H36N.Br3/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-3-2/h5-16H2,1-4H3;/q+1;-1
2.1.2 InChI Key
XXSLZJZUSYNITM-UHFFFAOYSA-N
2.1.3 Canonical SMILES
CCCC[N+](CCCC)(CCCC)CCCC.Br[Br-]Br
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 38932-80-8

2. N,n,n,n-tetrabutylammonium Tribromide

3. Tetrabutyl Ammonium Tribromide

4. Tetra-n-butylammonium Tribromide

5. Mono(tetrabutylammonium) Tribromide

6. Tbabr3

7. Tetrabutylammonium Bromide Perbromide

8. Mfcd00012110

9. Tetrabutylam-monium Tribromide

10. Schembl19182755

11. Dtxsid801028457

12. Tetrabutylammonium Tribromide, 98%

13. Ac-773

14. N,n,n,n-tetrabutylammoniumtribromide

15. Akos015963340

16. Ds-4304

17. T1284

18. A824335

19. Q7706217

20. Tetrabutylammonium Tribromide, Purum, >=98.0% (rt)

21. Tetrabutylammonium Tribromide;n,n,n,n-tetrabutylammonium Tribromide

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 482.2 g/mol
Molecular Formula C16H36Br3N
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count12
Exact Mass481.03774 g/mol
Monoisotopic Mass479.03979 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count20
Formal Charge0
Complexity116
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

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