19692-45-6

Chemistry, 2 End Use API, 3 Related Intermediates

Manufacturers/Suppliers

2 Suppliers

2 Suppliers

Also known as: 19692-45-6, 4-tert-butylbenzyl chloride, 1-(tert-butyl)-4-(chloromethyl)benzene, 1-tert-butyl-4-(chloromethyl)benzene, 4-(tert-butyl)benzyl chloride, Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)-

Molecular Formula

C₁₁H₁₅Cl

Molecular Weight

182.69 g/mol

InChI Key

WAXIFMGAKWIFDQ-UHFFFAOYSA-N

1 2D Structure

19692-45-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-tert-butyl-4-(chloromethyl)benzene

2.1.2 InChI

InChI=1S/C11H15Cl/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,8H2,1-3H3

2.1.3 InChI Key

WAXIFMGAKWIFDQ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C)(C)C1=CC=C(C=C1)CCl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 19692-45-6

2. 4-tert-butylbenzyl Chloride

3. 1-(tert-butyl)-4-(chloromethyl)benzene

4. 1-tert-butyl-4-(chloromethyl)benzene

5. 4-(tert-butyl)benzyl Chloride

6. Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)-

7. 4-

8. Tert

9. -butylbenzyl Chloride

10. 4-(tert-butyl) Benzyl Chloride

11. P-tert-butyl-.alpha.-chlorotoluene

12. 4-(tert-butyl)benzylchloride

13. 4-tert-butylbenzylchloride

14. P-tert-butyl-alpha-chlorotoluene

15. P-(tert-butyl)-alpha-chlorotoluene

16. Einecs 243-228-8

17. 4-t-butylbenzylchloride

18. 4-t-butylbenzyl Chloride

19. P-(t-butyl)benzyl Chloride

20. 4-tert. Butylbenzylchloride

21. 4-tert.butylbenzyl Chloride

22. Benzene, 1-chloromethyl-4-(1,1-dimethylethyl)-

23. 4-tert-butyl-benzyl Chloride

24. 4-tert.-butylbenzyl Chloride

25. 4-tert.-butyl-benzyl Chloride

26. Schembl1204683

27. P-t-butylbenzyl Chloride

28. 4-(tert-butyl)-a-chlorotoluene

29. Dtxsid7066516

30. 4-tert-butyl-alpha-chlorotoluene

31. Waxifmgakwifdq-uhfffaoysa-

32. 1-chloromethyl-4-tert-butylbenzene

33. 1-tert-butyl-4-chloromethylbenzene

34. 4-tert-butylbenzyl Chloride, 99%

35. Bbl100032

36. Mfcd00000918

37. Stl185568

38. Akos000268738

39. 1-tert-butyl-4-(chloromethyl)-benzene

40. Sc10144

41. 1-tert-butyl-4-(chloromethyl)benzene #

42. Ac-26173

43. As-12156

44. Am20030274

45. B2235

46. Benzene,1-(chloromethyl)-4-dimethylethyl)-

47. Ft-0619476

48. En300-21670

49. A22486

50. W-107685

51. Inchi=1/c11h15cl/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7h,8h2,1-3h3

52. 1-(chloromethyl)-4-(1,1-dimethylethyl)-benzene;p-t-butylbenzyl Chloride;p-tert-butylbenzyl Chloride

2.3 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₅Cl
Molecular Weight	182.69 g/mol
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	0
Heavy Atom Count	12
Formal Charge	0
Complexity	126
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1