CAS 1193-21-1

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79 Related Intermediates

Chemistry

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Also known as: 1193-21-1, Pyrimidine, 4,6-dichloro-, 4,6-dichloro-pyrimidine, 4,6-dichloro pyrimidine, Mfcd00006109, Dichloropyrmidine

Molecular Formula

C₄H₂Cl₂N₂

Molecular Weight

148.98 g/mol

InChI Key

XJPZKYIHCLDXST-UHFFFAOYSA-N

1 2D Structure

CAS 1193-21-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4,6-dichloropyrimidine

2.1.2 InChI

InChI=1S/C4H2Cl2N2/c5-3-1-4(6)8-2-7-3/h1-2H

2.1.3 InChI Key

XJPZKYIHCLDXST-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=C(N=CN=C1Cl)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1193-21-1

2. Pyrimidine, 4,6-dichloro-

3. 4,6-dichloro-pyrimidine

4. 4,6-dichloro Pyrimidine

5. Mfcd00006109

6. Dichloropyrmidine

7. Dichloropyrimidine

8. Nsc37530

9. Einecs 214-770-2

10. Nsc 37530

11. 4,6-dichloropyrimdine

12. 4,6-dichloropyrimidin

13. 4,6-dichlorpyrimidine

14. 4,6 Dichloropyrimidine

15. 4,6-dichioropyrimidine

16. 4,6-dichlor-pyrimidine

17. 4,6-dichloropyrirnidine

18. 4,6- Dichloropyrimidine

19. Ai3-26563

20. 4, 6 Dichloro Pyrimidine

21. Ec 214-770-2

22. Schembl39924

23. 4,6-dichloropyrimidine, 97%

24. Chembl1992013

25. Dtxsid10152403

26. Act10415

27. Bcp16087

28. Str03622

29. Zinc1670096

30. Nsc-37530

31. Stl197981

32. Akos001295631

33. Ab00591

34. Ac-2906

35. Cs-w018513

36. Nci60_003520

37. Db-006597

38. Am20080738

39. Bb 0242417

40. D2488

41. Ft-0617248

42. En300-25606

43. A18118

44. Q-200421

45. F2124-0077

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₂Cl₂N₂
Molecular Weight	148.98 g/mol
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	147.9595035 g/mol
Monoisotopic Mass	147.9595035 g/mol
Topological Polar Surface Area	25.8 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	70.4
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