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ACTIVE PHARMA INGREDIENTS

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Chemistry

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Also known as: Dl-lactide, 95-96-5, Lactide, Dilactide, 1,4-dioxane-2,5-dione, 3,6-dimethyl-, 3,6-dimethyl-2,5-dioxo-1,4-dioxane

Molecular Formula

C₆H₈O₄

Molecular Weight

144.12 g/mol

InChI Key

JJTUDXZGHPGLLC-UHFFFAOYSA-N

FDA UNII

7EH08MWO6M

1 2D Structure

L-Lactide

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3,6-dimethyl-1,4-dioxane-2,5-dione

2.1.2 InChI

InChI=1S/C6H8O4/c1-3-5(7)10-4(2)6(8)9-3/h3-4H,1-2H3

2.1.3 InChI Key

JJTUDXZGHPGLLC-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1C(=O)OC(C(=O)O1)C

2.2 Other Identifiers

2.2.1 UNII

7EH08MWO6M

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Dilactide

2. Lactide

2.3.2 Depositor-Supplied Synonyms

1. Dl-lactide

2. 95-96-5

3. Lactide

4. Dilactide

5. 1,4-dioxane-2,5-dione, 3,6-dimethyl-

6. 3,6-dimethyl-2,5-dioxo-1,4-dioxane

7. P-dioxane-2,5-dione, 3,6-dimethyl-

8. Lactic Acid, Bimol. Cyclic Ester

9. Dl-dilactide

10. 26680-10-4

11. Propanoic Acid, 2-hydroxy-, Bimol. Cyclic Ester

12. 7eh08mwo6m

13. Nsc-403080

14. 33135-50-1

15. Purasorb Dl; Dl-dilactide; Rac-lactide

16. Einecs 202-468-3

17. Unii-7eh08mwo6m

18. Nsc 403080

19. Lactid

20. Hexythlazox

21. Rac-lactide

22. Ai3-05059

23. Mfcd00070594

24. Mfcd00082566

25. L-polylactide(plla)

26. Dimethylglycolide

27. 3,6-dimethyl-[1,4]dioxane-2,5-dione

28. Lactide, Dl-

29. Ec 202-468-3

30. 3,5-dioxo-1,4-dioxane

31. Dsstox_cid_21253

32. Dsstox_rid_79665

33. 3,6-dimethyl-1,4-dioxane-2,5-dione Homopolymer

34. Dsstox_gsid_41253

35. Schembl15034

36. 1,5-dione, 3,6-dimethyl-

37. P-dioxane-2, 3,6-dimethyl-

38. Chembl3185272

39. Dtxsid7041253

40. Chebi:177651

41. Bcp34367

42. Propanoic Acid, Bimol. Cyclic Ester

43. Tox21_302164

44. Mfcd00011685

45. Nsc403080

46. L-polylactide(plla);l-(-)-lactide

47. Akos005206744

48. Cas-95-96-5

49. Ncgc00255679-01

50. As-17933

51. Sy026985

52. Sy060845

53. Dl-3,6-dimethyl-1,4-dioxane-2,5-dione

54. L-3,6-dimethyl-1,4-dioxane-2,5-dione

55. 3,6-dimethyl-p-dioxane-2,5-dione

56. Db-070627

57. Db-080384

58. Ft-0601997

59. Ft-0625454

60. L0091

61. 2,5-dimethyl-3,6-dioxo-1,4-dioxane

62. D81885

63. A826719

64. Q421313

65. (3s)-cis-3,6-dimethyl-1,4-dioxane-2,5-dione 98%

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₆H₈O₄
Molecular Weight	144.12 g/mol
XLogP3	0.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	144.04225873 g/mol
Monoisotopic Mass	144.04225873 g/mol
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	155
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1