CAS 20059-73-8

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Also known as: 20059-73-8, 2-(4-(aminomethyl)phenoxy)-n,n-dimethylethanamine, P-(2-(dimethylamino)ethoxy)benzylamine, 2-[4-(aminomethyl)phenoxy]-n,n-dimethylethanamine, 4-(2-dimethylamino)ethoxy-benzylamine, 4-(2-dimethylamino)-ethoxybenzylamine

Molecular Formula

C₁₁H₁₈N₂O

Molecular Weight

194.27 g/mol

InChI Key

OBHPRQNPNGQGCK-UHFFFAOYSA-N

1 2D Structure

CAS 20059-73-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-[4-(aminomethyl)phenoxy]-N,N-dimethylethanamine

2.1.2 InChI

InChI=1S/C11H18N2O/c1-13(2)7-8-14-11-5-3-10(9-12)4-6-11/h3-6H,7-9,12H2,1-2H3

2.1.3 InChI Key

OBHPRQNPNGQGCK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN(C)CCOC1=CC=C(C=C1)CN

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 20059-73-8

2. 2-(4-(aminomethyl)phenoxy)-n,n-dimethylethanamine

3. P-(2-(dimethylamino)ethoxy)benzylamine

4. 2-[4-(aminomethyl)phenoxy]-n,n-dimethylethanamine

5. 4-(2-dimethylamino)ethoxy-benzylamine

6. 4-(2-dimethylamino)-ethoxybenzylamine

7. [2-(4-aminomethyl-phenoxy)-ethyl]-dimethyl-amine

8. P-[2-(dimethylamino)ethoxy]benzylamine

9. 4-[2-(dimethylamino) Ethoxy] Benzylamine

10. Benzenemethanamine, 4-[2-(dimethylamino)ethoxy]-

11. {4-[2-(dimethylamino)ethoxy]phenyl}methanamine

12. Mfcd01075231

13. 4-(2-(dimethylamino)ethoxy)benzylamine

14. (4-[2-(dimethylamino)ethoxy]phenyl)methanamine

15. Einecs 243-491-9

16. Schembl110426

17. Schembl4607528

18. Dtxsid10173870

19. Zinc1670264

20. 4-(2-dimethylaminoethoxy)benzylamine

21. 4-(2-dimethylaminoethoxy)benzyl Amine

22. Akos000131378

23. Am84687

24. Cs-w002738

25. Mb01683

26. 4-(2-dimethylamino)-ethoxy-benzylamine

27. 4-[2-(dimethylamino)ethoxy] Benzylamine

28. 4-[2-(dimethylamino)ethoxy]-benzylamine

29. 4-[2-(dimethylamino)ethoxy]benzyl Amine

30. Ac-15247

31. Ds-16636

32. Sy005516

33. 4-[(2-dimethylamino) Ethoxy] Benzylamine

34. Db-045073

35. Ft-0617303

36. 4-[2-(dimethylamino)ethoxy]benzenemethanamine

37. En300-43395

38. 059d738

39. 4-(2-dimethylamino)-ethoxybenzylamine, Aldrichcpr

40. W-107654

41. N-(2-[4-(aminomethyl)phenoxy]ethyl)-n,n-dimethylamine

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₈N₂O
Molecular Weight	194.27 g/mol
XLogP3	0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	194.141913202 g/mol
Monoisotopic Mass	194.141913202 g/mol
Topological Polar Surface Area	38.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	142
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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