CAS 31251-41-9 manufacturers and suppliers on PharmaCompass

PharmaCompass

Chemistry

Click the arrow to open the dropdown
read-moreClick the button for full data set
Also known as: 31251-41-9, 8-chloro-5h-benzo[5,6]cyclohepta[1,2-b]pyridin-11(6h)-one, 8-chloro-5,6-dihydro-11h-benzo(5,6)cyclohepta(1,2-b)pyridin-11-one, Loratadine related compound c, Loratadine ep impurity b, 8-chloro-10,11-dihydro-4-aza-5h-dibenzo-(a,d)cycloheptan-5-one
Molecular Formula
C14H10ClNO
Molecular Weight
243.69  g/mol
InChI Key
WMQNOYVVLMIZDV-UHFFFAOYSA-N
FDA UNII
Y8MA5G8500

CAS 31251-41-9
1 2D Structure

CAS 31251-41-9

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-one
2.1.2 InChI
InChI=1S/C14H10ClNO/c15-11-5-6-12-10(8-11)4-3-9-2-1-7-16-13(9)14(12)17/h1-2,5-8H,3-4H2
2.1.3 InChI Key
WMQNOYVVLMIZDV-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC2=C(C=CC(=C2)Cl)C(=O)C3=C1C=CC=N3
2.2 Other Identifiers
2.2.1 UNII
Y8MA5G8500
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 31251-41-9

2. 8-chloro-5h-benzo[5,6]cyclohepta[1,2-b]pyridin-11(6h)-one

3. 8-chloro-5,6-dihydro-11h-benzo(5,6)cyclohepta(1,2-b)pyridin-11-one

4. Loratadine Related Compound C

5. Loratadine Ep Impurity B

6. 8-chloro-10,11-dihydro-4-aza-5h-dibenzo-(a,d)cycloheptan-5-one

7. 8-chloro-10,11-dihydro-4-aza-5h-dibenzo[a,d]cycloheptan-5-one

8. 11h-benzo[5,6]cyclohepta[1,2-b]pyridin-11-one, 8-chloro-5,6-dihydro-

9. 13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-one

10. 8-chloro-10,11-dihydro-4-aza-5h-benzo[a,d] Cycloheptan-5-one

11. Y8ma5g8500

12. Mfcd00800222

13. 8-chloro-5,6-dihydro-11h-benzo[5.6]cyclohepta[1,2-b]pyridin-11-one

14. Unii-y8ma5g8500

15. 8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-11-one

16. Loratadine Specified Impurity B [ep]

17. Loratadine Related Compound C Rs [usp]

18. Ec 700-257-5

19. Schembl3839936

20. Dtxsid40185183

21. Bcp31805

22. Zinc2569976

23. Akos005067771

24. Ac-26332

25. As-12268

26. Loratadine Impurity, 8-chloro-6,11-dihydro-5h-benzo(5,6)cyclohepta(1,2-b)pyridin-11-one- [usp]

27. Sy053120

28. Loratadine Impurity B [ep Impurity]

29. Cs-0022883

30. Ft-0638960

31. Loratadine Ep Impurity B ( Usp Rc C)

32. A18619

33. Loratadine Related Compound C [usp-rs]

34. 251c419

35. Loratadine Related Compound C [usp Impurity]

36. Q27294379

37. 8-chloro-10,11-dihydro-4-aza-5h-dibenzo-(a,d)cycloheptan-5one

38. 8-chloro-10,11-dihydro-4-aza-5h-dibenzo[a,d]cyclohepten-5-one

39. 8-chloro-10,11-dihydro-4 Aza-5h-benzo[a,d] Cycloheptan-5-one

40. 8-chloro-5,6-dihydro-11 H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-one

41. 8-chloro-5,6-dihydro-11h-benzo [5,6]cyclohepta [1,2-b]pyrid-11-one

42. 8-chloro-5,6-dihydro-11h-benzo[5,6]cyclo Hepta[1,2-b]pyridin-11-one

43. 8-chloro-5,6-dihydro-11h-benzo[5,6]cyclohepta[1,2-b]pyrid-11-one

44. Loratadine Impurity, 8-chloro-6,11-dihydro-5h-benzo(5,6)cyclohepta(1,2-b)pyridin-11-one- [usp Impurity]

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 243.69 g/mol
Molecular Formula C14H10ClNO
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass243.0450916 g/mol
Monoisotopic Mass243.0450916 g/mol
Topological Polar Surface Area30 Ų
Heavy Atom Count17
Formal Charge0
Complexity307
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

Upload your portfolio for free, ask us

END USE APIs

read-more
read-more

MARKET PLACE

Do you need sourcing support? Ask us
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