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2D Structure
Also known as: 4-aminobutan-1-ol, 13325-10-5, 4-aminobutanol, 1-butanol, 4-amino-, 4-hdyroxybutylamine, 4-amino-butan-1-ol
Molecular Formula
C4H11NO
Molecular Weight
89.14  g/mol
InChI Key
BLFRQYKZFKYQLO-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-aminobutan-1-ol
2.1.2 InChI
InChI=1S/C4H11NO/c5-3-1-2-4-6/h6H,1-5H2
2.1.3 InChI Key
BLFRQYKZFKYQLO-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C(CCO)CN
2.2 Synonyms
2.2.1 MeSH Synonyms

1. 4-aminobutanol

2.2.2 Depositor-Supplied Synonyms

1. 4-aminobutan-1-ol

2. 13325-10-5

3. 4-aminobutanol

4. 1-butanol, 4-amino-

5. 4-hdyroxybutylamine

6. 4-amino-butan-1-ol

7. 4-hydroxybutylamine

8. Mfcd00008230

9. Butanolamine

10. 4-amino Butanol

11. 4-amino-butanol

12. 4amino-1-butanol

13. 4-aminobutanol-1

14. Einecs 236-364-4

15. 4-amino 1-butanol

16. 4-aminobutyl Alcohol

17. 4-hydroxy-butylamine

18. H-abut(4)-ol

19. 4-amino-butan-1-o1

20. 2-(aminoethyl)-ethanol

21. 1-amino-4-hydroxybutane

22. Ai3-28710

23. N-(4-hydroxybutyl)amine

24. 2-(2-aminoethyl)ethanol

25. 4-amino-1-butanol, 98%

26. H2n(ch2)4oh

27. Nh2(ch2)4oh

28. H2nch2(ch2)2ch2oh

29. Dtxsid70158027

30. Act08231

31. Amy17788

32. Bcp18612

33. Zinc2019709

34. Ac-034

35. Bbl102556

36. Stl556359

37. Akos002670517

38. Cs-w002041

39. Gs-3086

40. Sb83786

41. Bp-30241

42. Bp-31085

43. Sy001196

44. Ft-0617430

45. Ft-0617431

46. 325a105

47. A806583

48. Q63392130

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 89.14 g/mol
Molecular Formula C4H11NO
XLogP3-1.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass89.084063974 g/mol
Monoisotopic Mass89.084063974 g/mol
Topological Polar Surface Area46.2 Ų
Heavy Atom Count6
Formal Charge0
Complexity23.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1