CAS 2081-44-9

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Also known as: 2081-44-9, Tetrahydro-4-pyranol, Oxan-4-ol, Tetrahydro-4h-pyran-4-ol, 4-hydroxytetrahydropyran, 2h-pyran-4-ol, tetrahydro-

Molecular Formula

C₅H₁₀O₂

Molecular Weight

102.13 g/mol

InChI Key

LMYJGUNNJIDROI-UHFFFAOYSA-N

FDA UNII

ZZ9W8N9YQV

1 2D Structure

CAS 2081-44-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

oxan-4-ol

2.1.2 InChI

InChI=1S/C5H10O2/c6-5-1-3-7-4-2-5/h5-6H,1-4H2

2.1.3 InChI Key

LMYJGUNNJIDROI-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1COCCC1O

2.2 Other Identifiers

2.2.1 UNII

ZZ9W8N9YQV

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 2081-44-9

2. Tetrahydro-4-pyranol

3. Oxan-4-ol

4. Tetrahydro-4h-pyran-4-ol

5. 4-hydroxytetrahydropyran

6. 2h-pyran-4-ol, Tetrahydro-

7. Tetrahydropyran-4-ol

8. Tetrahydro-pyran-4-ol

9. 4-hydroxytetrahydro-4h-pyran

10. Mfcd00006633

11. Zz9w8n9yqv

12. Tetrahydro-2h-4-pyranol

13. 4-tetrahydropyranol

14. Tetrahydo-4-pyranol

15. Tetrahydro-pyran-4ol

16. 4-hydroxy Tetrahydropyran

17. 4-hydroxy-tetrahydropyran

18. Tetrahydro-4h-4-pyranol

19. Unii-zz9w8n9yqv

20. 4-hydroxy-tetrahydropyrane

21. 4-hydroxy-tetrahydro-pyran

22. Tetrahydro-4h-pyrane-4-ol

23. Tetrahydro-2 H-pyran-4-ol

24. 4-hydroxytetrahydro-2h-pyra

25. Schembl40046

26. Tetrahydro-4-pyranol, 98%

27. Tetrahydro-2h-pyran-4-ol #

28. 4-hydroxy-tetrahydro-2h-pyran

29. Dtxsid90174921

30. Zinc391950

31. Act01892

32. Albb-016822

33. Bcp04889

34. Str05888

35. Einecs 218-210-8

36. 4-hydroxytetrahydro-2h-pyran

37. Bbl104257

38. Geo-03742

39. Stl558360

40. Akos005217306

41. As-5529

42. Cs-w004264

43. Pb11583

44. Sb10338

45. Tetrahydropyran-4-ol ; 2h-pyran-4-ol

46. Sy002687

47. Db-007912

48. Am20090170

49. Ft-0634020

50. Ft-0659090

51. T2825

52. En300-53372

53. 081t449

54. Tetrahydro-2h-pyran-4-ol;4-hydroxytetrahydropyran

55. W-109037

56. F0001-0743

57. Z1359429523

58. 4-hydroxytetrahydropyran Tetrahydro-4-pyranol Tetrahydro-2h-pyran-4-ol Tetrahydro-4h-pyran-4-ol 2h-pyran-4-ol, Tetrahydro- Oxan-4-ol Zinc00391950 4-hydroxytetrahydropyran Ac1l2mxq Ac1q7aqa Ac1q7aq9

2.4 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₀O₂
Molecular Weight	102.13 g/mol
XLogP3	-0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	102.068079557 g/mol
Monoisotopic Mass	102.068079557 g/mol
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	48
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