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Also known as: 17247-58-4, Cyclobutylmethyl bromide, Bromomethylcyclobutane, Cyclobutane, (bromomethyl)-, Bromomethyl cyclobutane, Mfcd00040960
Molecular Formula
C5H9Br
Molecular Weight
149.03  g/mol
InChI Key
FLHFTXCMKFVKRP-UHFFFAOYSA-N

CAS 17247-58-4
1 2D Structure

CAS 17247-58-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
bromomethylcyclobutane
2.1.2 InChI
InChI=1S/C5H9Br/c6-4-5-2-1-3-5/h5H,1-4H2
2.1.3 InChI Key
FLHFTXCMKFVKRP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC(C1)CBr
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 17247-58-4

2. Cyclobutylmethyl Bromide

3. Bromomethylcyclobutane

4. Cyclobutane, (bromomethyl)-

5. Bromomethyl Cyclobutane

6. Mfcd00040960

7. Cyclobutylmethylbromide

8. Bromomethyl-cyclobutane

9. Cydobutyl-methylbromide

10. (bromomethyl)cyclobutan

11. Cyclobutyl Methyl Bromide

12. (bromomethyl) Cyclobutane

13. (bromomethyl)-cyclobutane

14. (cyclobutyl)methyl Bromide

15. 1-(bromomethyl)cyclobutane

16. Ec 700-027-4

17. Schembl67906

18. (bromomethyl)cyclobutane, 97%

19. Dtxsid10370428

20. Act03403

21. Bcp18414

22. Zinc2390042

23. Bbl102967

24. Stl556776

25. Akos009158288

26. Pb47647

27. Ac-19697

28. As-36688

29. Db-015880

30. Am20070598

31. Cs-0015296

32. Ft-0623249

33. En300-91516

34. 2-fluoro-1-methylpyridinium P-toluenesulphonate?

35. 247b584

36. Q-200020

37. F0001-0626

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 149.03 g/mol
Molecular Formula C5H9Br
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass147.98876 g/mol
Monoisotopic Mass147.98876 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count6
Formal Charge0
Complexity39.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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