CAS 90-60-8

Chemistry, 1 End Use API

Chemistry
1 End Use API

Manufacturers/Suppliers

1 Suppliers

1 Suppliers

Also known as: 3,5-dichloro-2-hydroxybenzaldehyde, 90-60-8, Benzaldehyde, 3,5-dichloro-2-hydroxy-, 2-hydroxy-3,5-dichlorobenzaldehyde, Salicylaldehyde, 3,5-dichloro-, 3,5-dichloro-2-hydroxy-benzaldehyde

Molecular Formula

C₇H₄Cl₂O₂

Molecular Weight

191.01 g/mol

InChI Key

FABVMBDCVAJXMB-UHFFFAOYSA-N

1 2D Structure

CAS 90-60-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3,5-dichloro-2-hydroxybenzaldehyde

2.1.2 InChI

InChI=1S/C7H4Cl2O2/c8-5-1-4(3-10)7(11)6(9)2-5/h1-3,11H

2.1.3 InChI Key

FABVMBDCVAJXMB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=C(C=C(C(=C1C=O)O)Cl)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 3,5-dichloro-2-hydroxybenzaldehyde

2. 90-60-8

3. Benzaldehyde, 3,5-dichloro-2-hydroxy-

4. 2-hydroxy-3,5-dichlorobenzaldehyde

5. Salicylaldehyde, 3,5-dichloro-

6. 3,5-dichloro-2-hydroxy-benzaldehyde

7. Mfcd00003320

8. 3,5-dichloro Salicylal

9. Nsc96393

10. Einecs 202-005-5

11. Nsc 96393

12. Salicylaldehyde,5-dichloro-

13. 3, 5-dichlorosalicylaldehyde

14. 3,5-dichloro-salicylaldehyde

15. Schembl294059

16. Unii-9k38c4j9w8

17. Chembl2063877

18. Dtxsid2059011

19. 9k38c4j9w8

20. Bdbm111019

21. 3,5-dichlorosalicylaldehyde, 99%

22. Amy14635

23. Benzaldehyde,5-dichloro-2-hydroxy-

24. 3,5-di-chloro-2-hydroxybenzaldehyde

25. Bbl027433

26. Nsc-96393

27. Stk038235

28. Zinc12358918

29. Akos000121474

30. Cs-w015857

31. Ps-3146

32. Ncgc00341599-01

33. Ac-15253

34. Sy036806

35. Db-022044

36. D1170

37. Ft-0614577

38. 90d608

39. Ab01332707-02

40. A843592

41. Ae-646/31214010

42. 3,5-dichloro-2-hydroxybenzaldehyde, Distilled Grade

43. Us8614253, .3-50

44. F2191-0158

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₇H₄Cl₂O₂
Molecular Weight	191.01 g/mol
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	189.9588348 g/mol
Monoisotopic Mass	189.9588348 g/mol
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	151
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