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2D Structure
Also known as: 3143-02-0, (3-methyloxetan-3-yl)methanol, 3-hydroxymethyl-3-methyloxetane, 3-oxetanemethanol, 3-methyl-, 3-hydroxymethyl-3-methyl-oxetane, 3-(hydroxymethyl)-3-methyloxetane
Molecular Formula
C5H10O2
Molecular Weight
102.13  g/mol
InChI Key
NLQMSBJFLQPLIJ-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(3-methyloxetan-3-yl)methanol
2.1.2 InChI
InChI=1S/C5H10O2/c1-5(2-6)3-7-4-5/h6H,2-4H2,1H3
2.1.3 InChI Key
NLQMSBJFLQPLIJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1(COC1)CO
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 3143-02-0

2. (3-methyloxetan-3-yl)methanol

3. 3-hydroxymethyl-3-methyloxetane

4. 3-oxetanemethanol, 3-methyl-

5. 3-hydroxymethyl-3-methyl-oxetane

6. 3-(hydroxymethyl)-3-methyloxetane

7. 3-methyloxetane-3-methanol

8. (3-methyl-3-oxetanyl)methanol

9. 3-methyl-3-hydroxymethyloxetane

10. Chembl4741849

11. (3-methyl-oxetan-3-yl)-methanol

12. Mfcd00010273

13. 3-oxetanemethanol, 3-methyl-, Homopolymer

14. Timtec-bb Sbb009078

15. 26221-62-5

16. C5h10o2

17. Schembl6002

18. 3-methyl-3-oxetane Methanol

19. (3-methyloxetane-3-yl)methanol

20. (3-methyloxetan-3-yl)-methanol

21. Nlqmsbjflqplij-uhfffaoysa-

22. Dtxsid90185350

23. (3-methyl-3-oxetanyl)methanol #

24. 3-methyl-3-(hydroxymethyl)oxetane

25. Zinc391225

26. 3-methyl-3-oxetanemethanol, 98%

27. Oxetane, 3-hydroxymethyl-3-methyl

28. Act04865

29. 3-(hydroxymethyl)-3-methyl Oxetane

30. Bbl027778

31. Bdbm50551690

32. Stl373440

33. Akos000121533

34. Ac-2106

35. Cs-w007726

36. Gs-3568

37. Pb20862

38. Sy004123

39. Db-003413

40. Am20020031

41. Ft-0613783

42. M1136

43. 2-(hydroxymethyl)-2-methyl-1,3-epoxypropane

44. A820847

45. F0001-0003

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 102.13 g/mol
Molecular Formula C5H10O2
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass102.068079557 g/mol
Monoisotopic Mass102.068079557 g/mol
Topological Polar Surface Area29.5 Ų
Heavy Atom Count7
Formal Charge0
Complexity66.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1