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Also known as: 14347-78-5, (r)-(2,2-dimethyl-1,3-dioxolan-4-yl)methanol, [(4r)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol, (r)-solketal, D-acetone glycerol, (r)-2,2-dimethyl-1,3-dioxolane-4-methanol
Molecular Formula
C6H12O3
Molecular Weight
132.16  g/mol
InChI Key
RNVYQYLELCKWAN-RXMQYKEDSA-N

14347-78-5
1 2D Structure

14347-78-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
2.1.2 InChI
InChI=1S/C6H12O3/c1-6(2)8-4-5(3-7)9-6/h5,7H,3-4H2,1-2H3/t5-/m1/s1
2.1.3 InChI Key
RNVYQYLELCKWAN-RXMQYKEDSA-N
2.1.4 Canonical SMILES
CC1(OCC(O1)CO)C
2.1.5 Isomeric SMILES
CC1(OC[C@H](O1)CO)C
2.2 Synonyms
2.2.1 MeSH Synonyms

1. 2,2-dimethyl-1,3-dioxolane-4-methanol

2. 2,2-dimethyl-1,3-dioxolane-4-methanol, (dl)-isomer

3. 2,2-dimethyl-1,3-dioxolane-4-methanol, (r)-isomer

4. 2,2-dimethyl-1,3-dioxolane-4-methanol, (s)-isomer

5. 2,2-dimethyl-1,3-dioxolane-4-methanol, Monosodium Salt

6. 2,2-dimethyl-4-hydroxymethyl-1,3-dioxolane

7. 2,3-isopropylidene-sn-glycerol

8. 2,3-o-isopropylideneglycerol

9. Glycerol Acetonide

2.2.2 Depositor-Supplied Synonyms

1. 14347-78-5

2. (r)-(2,2-dimethyl-1,3-dioxolan-4-yl)methanol

3. [(4r)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

4. (r)-solketal

5. D-acetone Glycerol

6. (r)-2,2-dimethyl-1,3-dioxolane-4-methanol

7. R-(-)-sollketal

8. Mfcd00003213

9. ((4r)-2,2-dimethyl-1,3-dioxolan-4-yl)methanol

10. L-(-)-1,2-isopropylideneglycerol

11. (r)-(-)-1,2-o-isopropylideneglycerol

12. (r)-glycerol Acetonide

13. Schembl220145

14. 2,3-isopropylidene-sn-glycerol

15. 2,3-o-isopropylidene-sn-glycerol

16. Dtxsid501317906

17. Amy22606

18. L-alpha,beta-isopropylidene Glycerol

19. Geo-01175

20. Akos005146048

21. Akos005257631

22. Cs-w008357

23. (r)-(-)-2,3-o-isopropylideneglycerol

24. As-14053

25. D1705

26. En300-90280

27. H10460

28. I-8370

29. (2,2-dimethyl-1,3-dioxolan-4-yl)methanol, D-

30. (r)-(-)-2,2-dimethyl-1,3-dioxolan-4-methanol

31. (r)-(2,2-dimethyl-[1,3]dioxolan-4-yl)methanol

32. (r)-(2,2-dimethyl-1,3-dioxolan-4-yl) Methanol

33. A808074

34. ((r)-2,2-dimethyl-[1,3]dioxolan-4-yl)-methanol

35. (r)-( )-2,2-dimethyl-1,3-dioxolane-4-methanol

36. (r)-(-)-2,2 Dimethyl-1,3-dioxolane-4-methanol

37. (r)-(-)-2,2,-dimethyl-1,3-dioxolane-4-methanol

38. (r)-(2,2-dimethyl-[1,3]dioxolan-4-yl)-methanol

39. 1,3-dioxolane-4-methanol, 2,2-dimethyl-, (r)-

40. ((4r)-2,2-dimethyl-[1,3]-dioxolan-4-yl)-methanol

41. ((4r)-2,2-dimethyl-[1,3]dioxolan-4-yl)-methanol

42. ((4r)-2,2-dimethyl-1,3-dioxolan-4-yl)methan-1-ol

43. ((4r)-2,2-dimethyl-1,3-dioxolan-4-yl)methan-l-ol

44. ((4r)-2,2-dimethyl-1,3-dioxolan4-yl)methan-1-ol

45. (r)-(-)-(2,2-dimethyl-1,3-dioxolan-4-yl)methanol

46. (r)-(+)-(2,2-dimethyl-[1,3]dioxolan-4-yl)-methanol

47. (r)-(-)-2,2-dimethyl-1,3-dioxolane-4-methanol, 98%

2.3 Create Date
2005-07-08
3 Chemical and Physical Properties
Molecular Weight 132.16 g/mol
Molecular Formula C6H12O3
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area38.7
Heavy Atom Count9
Formal Charge0
Complexity101
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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