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(1R,2S)-L-Nmethylephedrine Hydrochloride
PharmaCompass
  • Chemistry
(1R,2S)-L-Nmethylephedrine Hydrochloride
Also known as: Methy f, (-)-methylephedrine hydrochloride, Unii-8ona78v6fo, N-methylephedrine hydrochloride, 38455-90-2, Einecs 253-947-9
Molecular Formula
C11H18ClNO
Molecular Weight
215.721  g/mol
InChI Key
NTCYWJCEOILKNG-ROLPUNSJSA-N
FDA UNII
8ONA78V6FO

1 2D Structure

(1R,2S)-L-Nmethylephedrine Hydrochloride

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1R,2S)-2-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
2.1.2 InChI
InChI=1S/C11H17NO.ClH/c1-9(12(2)3)11(13)10-7-5-4-6-8-10;/h4-9,11,13H,1-3H3;1H/t9-,11-;/m0./s1
2.1.3 InChI Key
NTCYWJCEOILKNG-ROLPUNSJSA-N
2.1.4 Canonical SMILES
CC(C(C1=CC=CC=C1)O)N(C)C.Cl
2.1.5 Isomeric SMILES
C[C@@H]([C@@H](C1=CC=CC=C1)O)N(C)C.Cl
2.2 Other Identifiers
2.2.1 UNII
8ONA78V6FO
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Methy F

2. (-)-methylephedrine Hydrochloride

3. Unii-8ona78v6fo

4. N-methylephedrine Hydrochloride

5. 38455-90-2

6. Einecs 253-947-9

7. Nsc 42289

8. L-erythro-methylephedrine Hydrochloride

9. 8ona78v6fo

10. L-methylephedrine Hydrochloride [jan]

11. (r-(r*,s*))-alpha-(1-(dimethylamino)ethyl)benzenemethanol Hydrochloride

12. Benzenemethanol, Alpha-(1-(dimethylamino)ethyl)-, Hydrochloride, (r-(r*,s*))-

13. L-n-methylephedrine Hydrochloride

14. (1r,2s)-2-(dimethylamino)-1-phenylpropan-1-ol Hydrochloride

15. L-methylephedrine Hydrochloride (jan)

16. N-methyl (-)ephedrine

17. Dl-n-methylephedrine Hydrochloride

18. Einecs 242-557-4

19. Methylephedrine Hydrochloride

20. 18760-80-0

21. Methylephedrine Hydrochloride, Dl-

22. Dl-methylephedrine Hydrochloride [jan]

23. 942-46-1

24. Ac1l54un

25. Schembl68363

26. Dtxsid10191776

27. Nsc42289

28. Nsc-42289

29. Akos030574097

30. Benzenemethanol, Alpha-(1-(dimethylamino)ethyl)-, Hydrochloride, (r*,s*)-(+-)- (9ci)

31. (r*,s*)-(1)-alpha-(1-(dimethylamino)ethyl)benzyl Alcohol Hydrochloride

32. Ls-30712

33. Benzyl Alcohol, Alpha-(1-(dimethylamino)ethyl)-, Hydrochloride, Erythro- (+-)-

34. Benzenemethanol,a-[1-(dimethylamino)ethyl]-

35. D01952

36. C-53769

37. Unii-99214p83xm Component Ntcywjceoilkng-rolpunsjsa-n

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 215.721 g/mol
Molecular Formula C11H18ClNO
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass215.108 g/mol
Monoisotopic Mass215.108 g/mol
Topological Polar Surface Area23.5 A^2
Heavy Atom Count14
Formal Charge0
Complexity141
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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