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CAS 2052-01-9

Chemistry, 1 End Use API, 30 Related Intermediates

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Also known as: 2052-01-9, 2-bromo-2-methylpropionic acid, 2-bromoisobutyric acid, Propanoic acid, 2-bromo-2-methyl-, Isobromobutyric acid, Alpha-bromoisobutyric acid

Molecular Formula

C₄H₇BrO₂

Molecular Weight

167.00 g/mol

InChI Key

XXSPGBOGLXKMDU-UHFFFAOYSA-N

FDA UNII

821P2R6B0A

1 2D Structure

CAS 2052-01-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-bromo-2-methylpropanoic acid

2.1.2 InChI

InChI=1S/C4H7BrO2/c1-4(2,5)3(6)7/h1-2H3,(H,6,7)

2.1.3 InChI Key

XXSPGBOGLXKMDU-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C)(C(=O)O)Br

2.2 Other Identifiers

2.2.1 UNII

821P2R6B0A

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 2052-01-9

2. 2-bromo-2-methylpropionic Acid

3. 2-bromoisobutyric Acid

4. Propanoic Acid, 2-bromo-2-methyl-

5. Isobromobutyric Acid

6. Alpha-bromoisobutyric Acid

7. .alpha.-bromoisobutyric Acid

8. 2-bromo-2-methyl-propanoic Acid

9. Propionic Acid, 2-bromo-2-methyl-

10. Alpha-bromoisobutyricacid

11. Mfcd00004168

12. 821p2r6b0a

13. Nsc-41213

14. 2-bromo-2-methyl-d3-propionic-3,3,3-d3 Acid

15. Ccris 9046

16. Bromoisobutyric Acid

17. Einecs 218-139-2

18. Nsc 41213

19. Bromo-isobutyric Acid

20. Alpha-bromo-alpha-methylpropionic Acid

21. 2-bromo-iso-butyric Acid

22. Schembl138469

23. Unii-821p2r6b0a

24. 2-methyl-2-bromopropionic Acid

25. 3-(3-hydroxyphenyl)benzoicacid

26. 2-bromo-2-methylproprionic Acid

27. Dtxsid8062151

28. Xxspgboglxkmdu-uhfffaoysa-

29. Nsc41213

30. Stl268877

31. Akos015841143

32. 2-bromo-2-methylpropionic Acid, 98%

33. Cs-w017850

34. As-13185

35. Bromo-2-methylpropionic Acid, 2-

36. .alpha.-bromoisobutyric Acid [mi]

37. .alpha.-bromo-.alpha.-methylpropionic Acid

38. Db-020589

39. Am20090161

40. B0605

41. Ft-0611570

42. En300-95625

43. Alpha-bromoisobutyric Acid, Purum, >=98.0% (gc)

44. W-107612

45. Q27269291

46. B2p

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₇BrO₂
Molecular Weight	167.00 g/mol
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	37.3
Heavy Atom Count	7
Formal Charge	0
Complexity	87.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

1289942-66-0

End Use API

Anupam Rasayan India Limited was started in 1976 and we are 36 years old. ISO 9001:2008 and ISO 14001:20...

Anupam Rasayan India Limited was started in 1976 and we are 36 years old. ISO 9001:2008 and ISO 14001:2004 certified chemical company with sound technology, environment consciousness, a rich history of innovation through research, and a total commitment to excellence in quality and customer satisfaction. ARIL is a manufacturer of Specialty Chemicals, with products catering to a plethora of market segments such as Pharmaceuticals, Agrochemicals, Pigments, Dyestuff, Material Sciences and Human Care. Our vision is to exploit to the maximum the potential of our extensive infrastructure and knowledge base, and then go beyond these to explore new horizons. Our objective is to grow exponentially in a multi-faceted manner through our chemistry, our technology and most importantly, through our customer support. ARIL thrives on its strong Research & Development and we have introduced numerous products for the first time in India. Many products have been introduced on an exclusive basis for our customers, for which we have entered into exclusivity agreements.

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