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2D Structure
Also known as: 637-87-6, 4-chloroiodobenzene, P-chloroiodobenzene, Benzene, 1-chloro-4-iodo-, 4-iodochlorobenzene, P-iodochlorobenzene
Molecular Formula
C6H4ClI
Molecular Weight
238.45  g/mol
InChI Key
GWQSENYKCGJTRI-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-chloro-4-iodobenzene
2.1.2 InChI
InChI=1S/C6H4ClI/c7-5-1-3-6(8)4-2-5/h1-4H
2.1.3 InChI Key
GWQSENYKCGJTRI-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1Cl)I
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 637-87-6

2. 4-chloroiodobenzene

3. P-chloroiodobenzene

4. Benzene, 1-chloro-4-iodo-

5. 4-iodochlorobenzene

6. P-iodochlorobenzene

7. 1-chloro-4-iodo-benzene

8. 4-chloro-1-iodobenzene

9. Mfcd00001053

10. 1-iodo-4-chlorobenzene

11. P-chlorjodbenzol

12. Nsc32862

13. Einecs 211-305-5

14. 4-chloro Iodobenzene

15. 4-chloro-iodobenzene

16. 4-iodo-chlorobenzene

17. Nsc 32862

18. P-iodophenyl Chloride

19. 4-chlorophenyl Iodide

20. L-chloro-4-iodobenzene

21. Para-chloro Iodo-benzene

22. 1-iodo-4-chloro-benzene

23. 1-chloro-4-iodobenzene?

24. 4-chloro-1-iodo-benzene

25. Schembl208292

26. 1-chloranyl-4-iodanyl-benzene

27. 1-chloro-4-iodobenzene, 99%

28. Dtxsid1060928

29. Zinc388036

30. Act07615

31. Str00382

32. Nsc-32862

33. Akos005146027

34. Cs-w007395

35. 3,3-carbonylbis(7-diethylaminocoumarin)

36. Bp-21181

37. Sy001143

38. Db-027397

39. A8774

40. Am20040928

41. Ft-0618217

42. D70840

43. 637c876

44. A834526

45. A929667

46. W-104876

47. F0001-1733

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 238.45 g/mol
Molecular Formula C6H4ClI
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass237.90463 g/mol
Monoisotopic Mass237.90463 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1