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Also known as: 220210-56-0, 3-tert-butoxycarbonylphenylboronic acid, 3-(t-butoxycarbonyl)phenylboronic acid, 3-t-butoxycarbonylphenylboronic acid, (3-(tert-butoxycarbonyl)phenyl)boronic acid, [3-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]boronic acid
Molecular Formula
C11H15BO4
Molecular Weight
222.05  g/mol
InChI Key
HVJDVHCPCSZDSR-UHFFFAOYSA-N

220210-56-0
1 2D Structure

220210-56-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[3-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]boronic acid
2.1.2 InChI
InChI=1S/C11H15BO4/c1-11(2,3)16-10(13)8-5-4-6-9(7-8)12(14)15/h4-7,14-15H,1-3H3
2.1.3 InChI Key
HVJDVHCPCSZDSR-UHFFFAOYSA-N
2.1.4 Canonical SMILES
B(C1=CC(=CC=C1)C(=O)OC(C)(C)C)(O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 220210-56-0

2. 3-tert-butoxycarbonylphenylboronic Acid

3. 3-(t-butoxycarbonyl)phenylboronic Acid

4. 3-t-butoxycarbonylphenylboronic Acid

5. (3-(tert-butoxycarbonyl)phenyl)boronic Acid

6. [3-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]boronic Acid

7. 3-(tert-butoxycarbonyl)benzeneboronic Acid

8. Mfcd01630855

9. [3-(tert-butoxycarbonyl)phenyl]boronic Acid

10. {3-[(tert-butoxy)carbonyl]phenyl}boronic Acid

11. Tert-butyl 3-boronobenzoate

12. 3-(tert-butoxycarbonylphenyl)boronic Acid

13. (3-tert-butoxycarbonylphenyl)boronic Acid

14. Boc-3-phenylboronic Acid

15. Schembl521171

16. Dtxsid40378351

17. Bcp15386

18. Cs-m2539

19. 3-t-butoxycarboxylphenylboronic Acid

20. 3-t-butoxycarbonyl Phenyl Boronic Acid

21. Akos005146522

22. Zinc169744977

23. Ab09321

24. Am84781

25. 3-tert-butoxycarbonylbenzeneboronic Acid

26. Ncgc00249537-01

27. 3-(tertbutoxycarbonyl)-phenylboronic Acid

28. As-15071

29. Sy025720

30. 3-(tert-butoxycarbonyl)-phenylboronic Acid

31. 3-(tert-butoxycarbonyl)phenyl-boronic Acid

32. 3-(tert-butoxycarbonylphenyl) Boronic Acid

33. 3-(tert-butoxycarbonyl)benzene Boronic Acid

34. Db-021748

35. B4726

36. Ft-0644020

37. M-(dihydroxyboryl)benzoic Acid Tert-butyl Ester

38. 716b472

39. A815834

40. J-510983

41. (3-tert-butoxycarbonylphenyl)boronic Acid;3-tert-butoxycarbonylphenylboronic Acid

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 222.05 g/mol
Molecular Formula C11H15BO4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass222.1063391 g/mol
Monoisotopic Mass222.1063391 g/mol
Topological Polar Surface Area66.8 Ų
Heavy Atom Count16
Formal Charge0
Complexity247
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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