1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-bromo-N-(2-methylphenyl)propanamide

2.1.2 InChI

InChI=1S/C10H12BrNO/c1-7-5-3-4-6-9(7)12-10(13)8(2)11/h3-6,8H,1-2H3,(H,12,13)

2.1.3 InChI Key

GUIZTZZUXVCLHZ-UHFFFAOYSA-N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 19397-79-6

2. 2-bromo-n-(o-tolyl)propanamide

3. 2-bromo-n-(o-tolyl)propionamide

4. Mfcd08670216

5. Einecs 243-027-5

6. Schembl11731600

7. Dtxsid50941095

8. Guiztzzuxvclhz-uhfffaoysa-n

9. Albb-007253

10. Sbb048699

11. Stk256729

12. Akos000100144

13. Akos016340800

14. Ls-02678

15. 2-bromo-n-(2-methylphenyl)propanimidic Acid

16. Cs-0434161

17. Ns00053824

18. St50401141

19. E84656

20. 2-bromo-n-(o-tolyl)propanamide (prilocaine Impurity)

2.3 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₂BrNO
Molecular Weight	242.11 g/mol
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	29.1
Heavy Atom Count	13
Formal Charge	0
Complexity	184
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

19397-79-6