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Technical details about (+)-Dibenzoyl Tartaric Acid, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 17026-42-5, (+)-dibenzoyl-d-tartaric acid, Butanedioic acid, 2,3-bis(benzoyloxy)-, (2s,3s)-, (+)-2,3-dibenzoyl-d-tartaric acid, (2s,3s)-2,3-bis(benzoyloxy)succinic acid, D-dibenzoyltartaric acid
Molecular Formula
C18H14O8
Molecular Weight
358.3  g/mol
InChI Key
YONLFQNRGZXBBF-KBPBESRZSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S,3S)-2,3-dibenzoyloxybutanedioic acid
2.1.2 InChI
InChI=1S/C18H14O8/c19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12/h1-10,13-14H,(H,19,20)(H,21,22)/t13-,14-/m0/s1
2.1.3 InChI Key
YONLFQNRGZXBBF-KBPBESRZSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O
2.1.5 Isomeric SMILES
C1=CC=C(C=C1)C(=O)O[C@@H]([C@@H](C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 17026-42-5

2. (+)-dibenzoyl-d-tartaric Acid

3. Butanedioic Acid, 2,3-bis(benzoyloxy)-, (2s,3s)-

4. (+)-2,3-dibenzoyl-d-tartaric Acid

5. (2s,3s)-2,3-bis(benzoyloxy)succinic Acid

6. D-dibenzoyltartaric Acid

7. (+)-o,o-dibenzoyltartaric Acid

8. (2s,3s)-(+)-dibenzoyltartaric Acid

9. (+)-dibenzoyltartaric Acid

10. Nsc-97424

11. O,o'-dibenzoyl D-tartaric Acid

12. [+]-dibenzoyltartaric Acid

13. (+)-dibenzoyl Tartaric Acid

14. [+]-dibenzoyl Tartaric Acid

15. Tartaric Acid, Dibenzoate, (+)-

16. Mfcd00063222

17. Dibenzoyl D-tartaric Acid

18. D-dibenzoyl Tartaric Acid

19. D-(+)-dibenzoyltartaric Acid

20. Einecs 241-097-1

21. D-(+)-di-o,o-benzoyltartaric Acid

22. Nsc 97424

23. (2s,3s)-2,3-dibenzoyloxybutanedioic Acid

24. Butanedioic Acid, 2,3-bis(benzoyloxy)-, (s-(r*,r*))-

25. (2s,3s)-(+)-dibenzoyl-d-tartaric Acid

26. Schembl223030

27. Chembl522816

28. ( )-dibenzoyl-d-tartaric Acid

29. D-tartaric Acid 2,3-dibenzoate

30. Dtxsid50884953

31. (+)-dibenzoyl-(d)-tartaric Acid

32. Nsc97424

33. Zinc1632636

34. 2-o,3-o-dibenzoyl-d-tartaric Acid

35. (+)-o,o'-dibenzoyl-d-tartaric Acid

36. Akos016842332

37. Ac-3431

38. Am81405

39. Cs-w020547

40. As-31014

41. Bp-12661

42. (+)-dibenzoyl-d-tartaric Acid, Anhydrous

43. D1398

44. D3826

45. 26d425

46. (s-(r*,r*))-2,3-bis(benzoyloxy)succinic Acid

47. Butanedioic Acid,3-bis(benzoyloxy)-, [s-(r*,r*)]-

48. (+)-2,3-dibenzoyl-d-tartaric Acid, >=99.0% (t)

49. (+)-2,3-dibenzoyl-d-tartaric Acid, >=98%, Made From Synthetic Tartaric Acid

2.3 Create Date
2005-07-11
3 Chemical and Physical Properties
Molecular Weight 358.3 g/mol
Molecular Formula C18H14O8
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass358.06886740 g/mol
Monoisotopic Mass358.06886740 g/mol
Topological Polar Surface Area127 Ų
Heavy Atom Count26
Formal Charge0
Complexity483
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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