CAS 38041-19-9

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3 Related Intermediates

Chemistry

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Also known as: 38041-19-9, Tetrahydro-2h-pyran-4-amine, Oxan-4-amine, Tetrahydro-pyran-4-ylamine, 4-aminotetrahyropyran, 4-aminotetrahydro-2h-pyran

Molecular Formula

C₅H₁₁NO

Molecular Weight

101.15 g/mol

InChI Key

AHVQYHFYQWKUKB-UHFFFAOYSA-N

1 2D Structure

CAS 38041-19-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

oxan-4-amine

2.1.2 InChI

InChI=1S/C5H11NO/c6-5-1-3-7-4-2-5/h5H,1-4,6H2

2.1.3 InChI Key

AHVQYHFYQWKUKB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1COCCC1N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 38041-19-9

2. Tetrahydro-2h-pyran-4-amine

3. Oxan-4-amine

4. Tetrahydro-pyran-4-ylamine

5. 4-aminotetrahyropyran

6. 4-aminotetrahydro-2h-pyran

7. 2h-pyran-4-amine, Tetrahydro-

8. Tetrahydropyran-4-ylamine

9. Tetrahydro-pyran-4-yl-amine

10. 4-aminotetrahydropyrane

11. 4-amino Tetrahydropyran

12. 4-amino-tetrahydropyran

13. 4-aminotetra-hydropyran

14. 4-aminotetrahydro-pyran

15. 4-tetrahydropyranylamine

16. 4-amino-tetrahydropyrane

17. 4-amino-tetrahydro-pyran

18. Tetrahydropyran-4-yl Amine

19. Tetrahydro-pyran-4-yl Amine

20. Schembl18165

21. (tetrahydro-pyran-4-yl)amine

22. 4-aminotetrahydropyran, 97%

23. Tetrahydro-2h-pyran-4-ylamine

24. Tetrahydropyran-4-amine

25. Amot0090

26. Dtxsid10329299

27. Act01871

28. Albb-005323

29. Bcp27526

30. Cs-b0654

31. Str10012

32. Zinc1529088

33. Mfcd02179436

34. Racemic Tetrahydro-2h-pyran-4-amine

35. Stk503349

36. Akos000285088

37. Ab11128

38. Ps-9313

39. Ncgc00341372-01

40. Ac-26798

41. Bp-10175

42. Db-006661

43. A6456

44. Am20100013

45. Ft-0601088

46. Ab00443048-02

47. Ab00443048-06

48. 041a199

49. J-514468

50. F0001-1086

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₁NO
Molecular Weight	101.15 g/mol
XLogP3	-0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	101.084063974 g/mol
Monoisotopic Mass	101.084063974 g/mol
Topological Polar Surface Area	35.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	50
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