Close
4

AbbVie Header AbbVie Header

X

CAS 694-80-4 manufacturers and suppliers on PharmaCompass

PharmaCompass
  • Chemistry
CAS 694-80-4
Also known as: 2-bromochlorobenzene, 694-80-4, 2-chlorobromobenzene, Bromochlorobenzene, O-bromochlorobenzene, O-chlorobromobenzene
Molecular Formula
C6H4BrCl
Molecular Weight
191.45  g/mol
InChI Key
QBELEDRHMPMKHP-UHFFFAOYSA-N
FDA UNII
PEC7Z3YX6P

1 2D Structure

CAS 694-80-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-bromo-2-chlorobenzene
2.1.2 InChI
InChI=1S/C6H4BrCl/c7-5-3-1-2-4-6(5)8/h1-4H
2.1.3 InChI Key
QBELEDRHMPMKHP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C(=C1)Cl)Br
2.2 Other Identifiers
2.2.1 UNII
PEC7Z3YX6P
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 2-bromochlorobenzene

2. 694-80-4

3. 2-chlorobromobenzene

4. Bromochlorobenzene

5. O-bromochlorobenzene

6. O-chlorobromobenzene

7. Benzene, 1-bromo-2-chloro-

8. 2-bromo-1-chlorobenzene

9. 1-chloro-2-bromobenzene

10. 1-bromo-2-chloro-benzene

11. Benzene, Bromochloro-

12. 28906-38-9

13. Pec7z3yx6p

14. Nsc-59694

15. 2-bromochluorobenzene

16. Unii-pec7z3yx6p

17. Unii-z0w07y466g

18. Chlorobromobenzene

19. Bromochlorobenzene (mixed Isomers)

20. 2-bromoclorobenzene

21. Einecs 211-775-1

22. Einecs 249-303-1

23. Mfcd00000532

24. Nsc 59694

25. 2-chlorophenyl Bromide

26. Ai3-31290

27. O-bromophenyl Chloride

28. 2-bromophenyl Chloride

29. Schembl251393

30. 1-bromanyl-2-chloranyl-benzene

31. 1-bromo-2-chlorobenzene, 99%

32. Dtxsid30870758

33. Z0w07y466g

34. Zinc404308

35. Nsc59694

36. Str07176

37. Akos005265527

38. Cs-w004051

39. Db-020717

40. 1-bromo-2-chlorobenzene, Analytical Standard

41. A9191

42. Am20050050

43. B0569

44. Ft-0611547

45. En300-31033

46. D77645

47. A836511

48. W-104621

49. Q27286505

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 191.45 g/mol
Molecular Formula C6H4BrCl
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass189.91849 g/mol
Monoisotopic Mass189.91849 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count8
Formal Charge0
Complexity74.9
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
Post Enquiry
POST ENQUIRY