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Also known as: 86-52-2, 1-chloromethyl naphthalene, Naphthalene, 1-(chloromethyl)-, 1-chloromethylnaphthalene, (chloromethyl)naphthalene, 1-naphthylmethyl chloride
Molecular Formula
C11H9Cl
Molecular Weight
176.64  g/mol
InChI Key
XMWGTKZEDLCVIG-UHFFFAOYSA-N
FDA UNII
KD3RZ3R8C4

CAS 86-52-2
1 2D Structure

CAS 86-52-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(chloromethyl)naphthalene
2.1.2 InChI
InChI=1S/C11H9Cl/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2
2.1.3 InChI Key
XMWGTKZEDLCVIG-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C2C(=C1)C=CC=C2CCl
2.2 Other Identifiers
2.2.1 UNII
KD3RZ3R8C4
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 1-chloromethylnaphthalene

2. 1-cl-me-naphthalene

3. 1-cmn

2.3.2 Depositor-Supplied Synonyms

1. 86-52-2

2. 1-chloromethyl Naphthalene

3. Naphthalene, 1-(chloromethyl)-

4. 1-chloromethylnaphthalene

5. (chloromethyl)naphthalene

6. 1-naphthylmethyl Chloride

7. 1-menaphthyl Chloride

8. 35255-58-4

9. Naphthalene, 1-chloromethyl-

10. 1-(chlormethyl)naftalen

11. Nsc 8473

12. 1-(chloromethyl)-naphthalene

13. .alpha.-(chloromethyl)naphthalene

14. 1-chloromethyl-naphthalene

15. 1-(chloromethyl)naphtalene

16. Kd3rz3r8c4

17. .alpha.-naphthylmethyl Chloride

18. Nsc-8473

19. Naphthalene, .alpha.-(chloromethyl)-

20. 1-(chloromethyl)-naphthalen

21. Alpha-naphthylmethyl Chloride

22. Alpha-(chloromethyl)naphthalene

23. Naphthalene, Alpha-chloromethyl-

24. 1-(chlormethyl)naftalen [czech]

25. 1-chloro Methylnaphthalene

26. Einecs 201-678-2

27. Brn 0636885

28. Naphthalene, (chloromethyl)-

29. Einecs 252-469-8

30. Mfcd00004042

31. Chloromethylnaphthalene

32. 1-chloromethylnaphthaline

33. 1-chloromethyinaphthalene

34. Ai3-15963

35. 1-chloromethyl-naphthalen

36. Alphachloromethylnaphthalene

37. Naphth-1-ylmethyl Chloride

38. Unii-kd3rz3r8c4

39. Alpha-chloromethylnaphthalene

40. (1-naphthyl)methyl Chloride

41. 1-naphthalenylmethyl Chloride

42. 1-(chloromethyl) Naphthalene

43. Alpha-chloromethyl-naphthalene

44. 4-05-00-01692 (beilstein Handbook Reference)

45. Schembl248239

46. Wln: L66j B1g

47. (1-naphthalenyl)methyl Chloride

48. Dtxsid5058939

49. Nsc8473

50. 1-(chloromethyl)naphthalene, 90%

51. Zinc1586767

52. Akos000120764

53. Ac-5784

54. Cs-w017388

55. Nsc 405486

56. Ls-13927

57. Ft-0607651

58. 1-bromo-2-(phenoxymethyl)benzene97+%

59. E70399

60. W-104064

61. Q63395890

62. 1-(chloromethyl)naphthalene, Technical, >=97.0% (gc)

63. F2190-0269

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 176.64 g/mol
Molecular Formula C11H9Cl
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass176.0392780 g/mol
Monoisotopic Mass176.0392780 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count12
Formal Charge0
Complexity144
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

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