CAS 1591-31-7  manufacturers and suppliers on PharmaCompass

Chemistry

Click the arrow to open the dropdown
read-moreClick the button for full data set
Also known as: 1591-31-7, 4-iodo-1,1'-biphenyl, 1,1'-biphenyl, 4-iodo-, 1-iodo-4-phenylbenzene, P-iodobiphenyl, Monoiodobiphenyl
Molecular Formula
C12H9I
Molecular Weight
280.10  g/mol
InChI Key
NXYICUMSYKIABQ-UHFFFAOYSA-N

CAS 1591-31-7 
1 2D Structure

CAS 1591-31-7 

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-iodo-4-phenylbenzene
2.1.2 InChI
InChI=1S/C12H9I/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
2.1.3 InChI Key
NXYICUMSYKIABQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)I
2.2 Synonyms
2.2.1 MeSH Synonyms

1. 4-iodobiphenyl, 125i-labeled

2.2.2 Depositor-Supplied Synonyms

1. 1591-31-7

2. 4-iodo-1,1'-biphenyl

3. 1,1'-biphenyl, 4-iodo-

4. 1-iodo-4-phenylbenzene

5. P-iodobiphenyl

6. Monoiodobiphenyl

7. 4-iododiphenyl

8. P-phenyliodobenzene

9. 4-biphenyl Iodide

10. Biphenyl, 4-iodo-

11. Mfcd00019028

12. 1-iodo-4-phenyl-benzene

13. 4-iodobiphenyl?

14. Nsc 3791

15. Einecs 216-469-1

16. 4-biphenylyl Iodide

17. 4-iodo-biphenyl

18. 4-iodobiphenyl, 97%

19. Ai3-15372

20. 4ibp

21. 1, 4-iodo-

22. 1-iodanyl-4-phenyl-benzene

23. Schembl45621

24. Dtxsid7061807

25. Nxyicumsykiabq-uhfffaoysa-

26. Nsc3791

27. Zinc980089

28. Act08162

29. Bcp06698

30. Nsc-3791

31. Bbl002447

32. Cx1310

33. Stk325713

34. Akos000275836

35. Cs-w002119

36. Gs-3356

37. Ol10131

38. Ac-22940

39. Sy014973

40. Am20030070

41. Ft-0630340

42. I0785

43. En300-18000

44. A810002

45. A935197

46. Ae-848/30708050

47. W-107988

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 280.10 g/mol
Molecular Formula C12H9I
XLogP34.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass279.97490 g/mol
Monoisotopic Mass279.97490 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count13
Formal Charge0
Complexity141
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty