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CAS 129722-34-5 manufacturers and suppliers on PharmaCompass

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CAS 129722-34-5
Also known as: 129722-34-5, 3,4-dihydro-7-(4-bromobutoxy)-2(1h)-quinolinone, 7-(4-bromobutoxy)-3,4-dihydro-2(1h)-quinolinone, 7-(4-bromo-butoxy)-3,4-dihydro-1h-quinolin-2-one, 7-(4-bromobutoxy)-3,4-dihydro-2-quinolinone, 7-(4-bromobutoxy)-3,4-dihydro-1h-quinolin-2-one
Molecular Formula
C13H16BrNO2
Molecular Weight
298.18  g/mol
InChI Key
URHLNHVYMNBPEO-UHFFFAOYSA-N

1 2D Structure

CAS 129722-34-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
7-(4-bromobutoxy)-3,4-dihydro-1H-quinolin-2-one
2.1.2 InChI
InChI=1S/C13H16BrNO2/c14-7-1-2-8-17-11-5-3-10-4-6-13(16)15-12(10)9-11/h3,5,9H,1-2,4,6-8H2,(H,15,16)
2.1.3 InChI Key
URHLNHVYMNBPEO-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC(=O)NC2=C1C=CC(=C2)OCCCCBr
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 129722-34-5

2. 3,4-dihydro-7-(4-bromobutoxy)-2(1h)-quinolinone

3. 7-(4-bromobutoxy)-3,4-dihydro-2(1h)-quinolinone

4. 7-(4-bromo-butoxy)-3,4-dihydro-1h-quinolin-2-one

5. 7-(4-bromobutoxy)-3,4-dihydro-2-quinolinone

6. 7-(4-bromobutoxy)-3,4-dihydro-1h-quinolin-2-one

7. 2(1h)-quinolinone, 7-(4-bromobutoxy)-3,4-dihydro-

8. (1h)-7-(4'-bromobutoxy)-3,4-dihydro-2-quinolinone

9. 7-(4-bromobutoxy)-3,4-dihydroquinolinone

10. 7-(4-bromobutoxy)-3,4-dihydroquinolin-2-one

11. Mfcd06658540

12. 7-(4-bromobutoxy)-2(1h)-3,4-dihydroquinolinone

13. Aripiprazole Impurity

14. Aripiprazole Intermediates

15. Schembl8513

16. 7-(4-bromobutoxy)-1,2,3,4-tetrahydro-2-oxoquinoline

17. Dtxsid00441550

18. Bcp08864

19. Cs-d1542

20. Bbl011057

21. Stk802231

22. Zinc15919788

23. Akos005622563

24. Ac-8060

25. Sb32672

26. 7-(4-bromobutoxy)-3,4-dihydroquinolin-

27. 7-(4bromobutoxy)-3,4-dihydrocarbostyril

28. Aripiprazole Bromobutoxyquinoline Impurity

29. As-14609

30. Sy023585

31. 7-(4-bromobutoxy) 3,4-dihydrocarbostyril

32. 7-(4-bromobutoxy)-3,4-dihydrocarbostyril

33. Db-017885

34. Am20090765

35. B3333

36. Ft-0643115

37. 722b345

38. A805968

39. 7-(4-bromo-butoxy)-3,4-dihydro-1h-quinolin-2one

40. A1-01685

41. 7-(4-bromobutoxy)-1,2,3,4-tetrahydroquinolin-2-one

42. 7-(4-bromobutoxy)-3,4-dihydroquinolin-2-one-[d8]

43. 7-(4-bromobutoxy)-1,2,3,4-tetrahydroquinoline-2-one

44. F2135-0630

45. 7-(4-bromobutoxy)-3,4-dihydro-1h-quinolin-2-one;7-(4-bromobutoxy)-3,4-dihydroquinolin-2(1h)-one

46. 7-(4-bromobutoxy)-3,4-dihydroquinolin-2-one; 3,4-dihydro-7-(4-bromobutoxy)-2(1h)-quinolinone; 7-(4-bromobutoxy)-3,4-dihydroquinolin-2(1h)-one

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 298.18 g/mol
Molecular Formula C13H16BrNO2
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass297.03644 g/mol
Monoisotopic Mass297.03644 g/mol
Topological Polar Surface Area38.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity260
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Brexpiprazole
Beijing Cooperate Pharmaceutical Co.,Ltd is a high-tech company specializing in pharmaceutical and advanc...
Beijing Cooperate Pharmaceutical Co.,Ltd is a high-tech company specializing in pharmaceutical and advanced material, involving API,pharmaceutical intermediates and petrochemical additives . we are the direct producer of some kinds of new pharmaceutical intermediates products what can be use for the treatment of disease of heart head blood-vessel, cancer,mental sickness and respiratory disease .
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70500-72-0
Brexpiprazole
Beijing Cooperate Pharmaceutical Co.,Ltd is a high-tech company specializing in pharmaceutical and advanc...
Beijing Cooperate Pharmaceutical Co.,Ltd is a high-tech company specializing in pharmaceutical and advanced material, involving API,pharmaceutical intermediates and petrochemical additives . we are the direct producer of some kinds of new pharmaceutical intermediates products what can be use for the treatment of disease of heart head blood-vessel, cancer,mental sickness and respiratory disease .
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