CAS 2144-08-3

Chemistry, 1 End Use API, 1 Related Intermediates

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Also known as: 2144-08-3, Pyrogallol-4-carboxaldehyde, Benzaldehyde, 2,3,4-trihydroxy-, Mfcd00003325, Chembl254077, Pyrogallolaldehyd

Molecular Formula

C₇H₆O₄

Molecular Weight

154.12 g/mol

InChI Key

CRPNQSVBEWWHIJ-UHFFFAOYSA-N

2,3,4-trihydroxybenzaldehyde is a natural product found in Pluchea sagittalis with data available.

1 2D Structure

CAS 2144-08-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,3,4-trihydroxybenzaldehyde

2.1.2 InChI

InChI=1S/C7H6O4/c8-3-4-1-2-5(9)7(11)6(4)10/h1-3,9-11H

2.1.3 InChI Key

CRPNQSVBEWWHIJ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C(=C1C=O)O)O)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 2144-08-3

2. Pyrogallol-4-carboxaldehyde

3. Benzaldehyde, 2,3,4-trihydroxy-

4. Mfcd00003325

5. Chembl254077

6. Pyrogallolaldehyd

7. Nsc22595

8. Einecs 218-404-2

9. Nsc 22595

10. Brn 2328658

11. Pyrogallol Aldehyde

12. 2,4-trihydroxybenzaldehyde

13. Dsstox_cid_31473

14. Dsstox_rid_97358

15. Dsstox_gsid_57684

16. Benzaldehyde,3,4-trihydroxy-

17. Schembl177256

18. 2,3,4-trihydroxy Benzaldehyde

19. 2,3,4-trihydroxy-benzaldehyde

20. Dtxsid9057684

21. Zinc1595754

22. Tox21_113928

23. Bdbm50234648

24. Nsc-22595

25. Stl183261

26. Akos004907179

27. Ccg-231105

28. Cs-w018058

29. Ncgc00262933-01

30. Ac-11255

31. As-12854

32. Bp-10570

33. Sy037740

34. Cas-2144-08-3

35. Db-045586

36. 2,3,4-trihydroxybenzaldehyde, 98%

37. Ft-0609391

38. T2158

39. 44t083

40. D71077

41. 3-08-00-03357 (beilstein Handbook Reference)

42. A815377

43. Sr-01000944725

44. Sr-01000944725-1

45. W-107553

46. Z1741978513

2.2.2 Other Synonyms

1. Benzaldehyde, 2,3,4-trihydroxy-

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₇H₆O₄
Molecular Weight	154.12 g/mol
XLogP3	0.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	154.02660867 g/mol
Monoisotopic Mass	154.02660867 g/mol
Topological Polar Surface Area	77.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	147
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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2,3,4-Trimethoxybenzaldehyde

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CAS Number

2103-57-3

End Use API

Established in 1990, Inabata France, a part of the Inabata Group, used to export chemical and pharmaceuti...

Established in 1990, Inabata France, a part of the Inabata Group, used to export chemical and pharmaceutical products to Japan. In 2006, it acquired Pharmasynthèse. Today, Inabata-Pharmasynthèse offers a wide range of services, including sourcing, manufacturing, and the development of raw materials for the pharmaceutical and cosmetic industries. It supplies these ingredients to Europe, Japan, and other countries. With expertise in fine chemical production, Inabata-Pharmasynthèse conducts manufacturing operations, ranging from pilot to commercial quantities, at its GMP-certified facility at St. Pierre-Les-Elbeuf in France.