CAS-93-04-9

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Chemistry

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Also known as: 93-04-9, Naphthalene, 2-methoxy-, Methyl 2-naphthyl ether, Nerolin, Yara yara, 2-naphthol methyl ether

Molecular Formula

C₁₁H₁₀O

Molecular Weight

158.20 g/mol

InChI Key

LUZDYPLAQQGJEA-UHFFFAOYSA-N

FDA UNII

VX2T1Z50C4

1 2D Structure

CAS 93-04-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-methoxynaphthalene

2.1.2 InChI

InChI=1S/C11H10O/c1-12-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3

2.1.3 InChI Key

LUZDYPLAQQGJEA-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COC1=CC2=CC=CC=C2C=C1

2.2 Other Identifiers

2.2.1 UNII

VX2T1Z50C4

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 93-04-9

2. Naphthalene, 2-methoxy-

3. Methyl 2-naphthyl Ether

4. Nerolin

5. Yara Yara

6. 2-naphthol Methyl Ether

7. Yura Yara

8. 2-naphthyl Methyl Ether

9. Yara-yara

10. Beta-naphthyl Methyl Ether

11. Nerolin (old)

12. 2-methoxy-naphthalene

13. Beta-methoxynaphthalene

14. .beta.-methoxynaphthalene

15. Beta-naphthol Mether Ether

16. Beta-naphthol Methyl Ether

17. Methyl Beta-naphthyl Ether

18. 2-methoxy Naphthalene

19. Nsc 4171

20. Nerolin Yara Yara

21. .beta.-naphthol Methyl Ether

22. .beta.-naphthyl Methyl Ether

23. Methyl .beta.-naphthyl Ether

24. 2-methoxynaphthalene(nerolin)

25. Chembl195857

26. Vx2t1z50c4

27. Nsc-4171

28. 2-naphthol Methyl Ether;2-naphthyl Methyl Ether

29. Einecs 202-213-6

30. Unii-vx2t1z50c4

31. Ai3-21213

32. Jara Jara

33. 2-methoxynaphtalene

34. 2-methoxynapthalene

35. Neroline Yara Yara

36. 6-methoxynaphthalene

37. Mfcd00004061

38. B-naphthyl Methyl Ether

39. Beta -methoxynaphthalene

40. Naproxen Ep Impurity M

41. Ec 202-213-6

42. Beta -naphthol Methyl Ether

43. Beta -naphthyl Methyl Ether

44. Methyl Beta -naphthyl Ether

45. 2-methoxynaphthalene, 99%

46. Dsstox_cid_24392

47. Dsstox_rid_80193

48. Dsstox_gsid_44392

49. Schembl112792

50. Nerolin Yara Yara, >=99%

51. 2-methoxynaphthalene, >=99%

52. Dtxsid7044392

53. Fema No. 4704

54. Schembl10250691

55. Nsc4171

56. 2-methoxynaphthalene [mi]

57. Chebi:177835

58. Zinc967412

59. Tox21_302143

60. Bdbm50159258

61. Mfcd31699956

62. Mfcd31699957

63. Akos008947868

64. Ac-4741

65. Cs-w010895

66. Ds-4954

67. Cas-93-04-9

68. Ncgc00255953-01

69. Naproxen Impurity M [ep Impurity]

70. Sy246288

71. Sy246289

72. Db-014139

73. Ft-0612855

74. M0117

75. D71164

76. Naproxen Sodium Impurity M [ep Impurity]

77. A844431

78. Af-676/00077048

79. J-509867

80. Q2240068

81. 2-methoxynaphthalene, Pharmaceutical Impurity Standard

82. Z53835290

83. Methyl 2-naphthyl Ether; 2-methoxynaphthalene; 2-naphthol Methyl Ether; 6-methoxy-2-naphthalene; ?-methoxynaphthalene

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₀O
Molecular Weight	158.20 g/mol
XLogP3	3.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	158.073164938 g/mol
Monoisotopic Mass	158.073164938 g/mol
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	144
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