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CAS 2103-57-3 manufacturers and suppliers on PharmaCompass

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CAS 2103-57-3
Also known as: 2103-57-3, Trimethoxybenzaldehyde, Benzaldehyde, 2,3,4-trimethoxy-, Benzaldehyde, trimethoxy-, 54061-90-4, Mfcd00003310
Molecular Formula
C10H12O4
Molecular Weight
196.20  g/mol
InChI Key
UCTUXUGXIFRVGX-UHFFFAOYSA-N
FDA UNII
7ZY3UK34C4

1 2D Structure

CAS 2103-57-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2,3,4-trimethoxybenzaldehyde
2.1.2 InChI
InChI=1S/C10H12O4/c1-12-8-5-4-7(6-11)9(13-2)10(8)14-3/h4-6H,1-3H3
2.1.3 InChI Key
UCTUXUGXIFRVGX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=C(C(=C(C=C1)C=O)OC)OC
2.2 Other Identifiers
2.2.1 UNII
7ZY3UK34C4
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 2103-57-3

2. Trimethoxybenzaldehyde

3. Benzaldehyde, 2,3,4-trimethoxy-

4. Benzaldehyde, Trimethoxy-

5. 54061-90-4

6. Mfcd00003310

7. 7zy3uk34c4

8. 2,3,4-trimethoxy-benzaldehyde

9. Einecs 258-950-9

10. Trimethoxy Benzaldehyde

11. Unii-7zy3uk34c4

12. Unii-jfk8h2k799

13. Schembl269268

14. 2,3,4-trimethoxybenz Aldehyde

15. Jfk8h2k799

16. Dtxsid6062179

17. 2,3,4-tri-methoxy Benzaldehyde

18. Act00416

19. Str05639

20. Zinc1841426

21. Einecs 218-271-0

22. Bbl010371

23. Stk506803

24. 2,3,4-trimethoxybenzaldehyde, 99%

25. Trimethoxybenzaldehyde (mixed Isomers)

26. Akos000119741

27. Ac-3239

28. Cs-w009209

29. Jc10173

30. Ps-5297

31. Sy004848

32. Ai3-36670

33. Db-024392

34. A4561

35. Am20060545

36. Ft-0609396

37. T1101

38. D70487

39. 103t573

40. Q-200163

41. Q63399810

42. 2,3,4-trimethoxybenzaldehyde, Purum, >=98.0% (hplc)

43. F0001-0752

44. Trimetazidine Dihydrochloride Impurity C [ep Impurity]

45. 2,3,4 Trimethoxybenzylaldehyde;2,3,4-trimethoxybenzaldehyde

46. 2,3,4-trimethoxybenzaldehyde, Certified Reference Material, Tracecert(r)

2.3.2 Other Synonyms

1. Benzaldehyde, 2,3,4-trimethoxy-

2. Trimethoxybenzaldehyde

2.4 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 196.20 g/mol
Molecular Formula C10H12O4
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass196.07355886 g/mol
Monoisotopic Mass196.07355886 g/mol
Topological Polar Surface Area44.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity183
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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