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CAS 138113-08-3
PharmaCompass
CAS 138113-08-3
Also known as: 7-methoxy-1-naphthylacetonitrile, 138113-08-3, (7-methoxy-1-naphthyl)acetonitrile, 1-naphthaleneacetonitrile, 7-methoxy-, 2-(7-methoxy-1-naphthyl)acetonitrile, 7-methoxy-1-naphthaleneacetonitrile
Molecular Formula
C13H11NO
Molecular Weight
197.237  g/mol
InChI Key
PYJMGUQHJINLLD-UHFFFAOYSA-N

1 2D Structure

CAS 138113-08-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(7-methoxynaphthalen-1-yl)acetonitrile
2.1.2 InChI
InChI=1S/C13H11NO/c1-15-12-6-5-10-3-2-4-11(7-8-14)13(10)9-12/h2-6,9H,7H2,1H3
2.1.3 InChI Key
PYJMGUQHJINLLD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC2=C(C=CC=C2CC#N)C=C1
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 7-methoxy-1-naphthylacetonitrile

2. 138113-08-3

3. (7-methoxy-1-naphthyl)acetonitrile

4. 1-naphthaleneacetonitrile, 7-methoxy-

5. 2-(7-methoxy-1-naphthyl)acetonitrile

6. 7-methoxy-1-naphthaleneacetonitrile

7. Ak-32305

8. Q-102532

9. (7-methoxynaphthalen-1-yl)acetonitrile

10. Acmc-1bw7x

11. Ksc169q5r

12. Schembl989652

13. Ctk0g9858

14. Ks-00000hys

15. Dtxsid90460472

16. 7-methoxy-1-naphthylmethylcyanide

17. Molport-003-848-639

18. Pyjmguqhjinlld-uhfffaoysa-n

19. 1-cyanomethyl-7-methoxynaphthalene

20. 7-methoxy-1-naphthyl Acetonitrile

21. (7-methoxynaphth-1-yl)acetonitrile

22. 7-methoxy-1-naphthaleneacetinitrile

23. 7-methoxynaphthalene-1-acetonitrile

24. Act03493

25. Zx-rl000424

26. (7-methoxy-naphth-1-yl)acetonitrile

27. Anw-46888

28. Cm0079

29. Mfcd08704309

30. Sbb068322

31. Zinc22062327

32. Akos006288808

33. Ls41041

34. Rp25535

35. Rtc-071158

36. (7-methoxy-naphthalen-1-yl)acetonitrile

37. Ac-24009

38. Aj-80908

39. An-31814

40. Cj-17308

41. Kb-46453

42. Or049229

43. Ts-02792

44. Ab0005092

45. Ax8162309

46. Db-001012

47. Tc-071158

48. 4ch-008805

49. Am20090762

50. Ft-0651955

51. M2421

52. St24029952

53. A25610

54. En300-117143

55. M-2290

56. 113m083

57. I14-6110

58. 1-cyanomethyl-7-methoxynaphthalene;2-(7-methoxy-1-naphthyl)acetonitrile;7-methoxy-1-naphthaleneacetinitrile

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 197.237 g/mol
Molecular Formula C13H11NO
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass197.084 g/mol
Monoisotopic Mass197.084 g/mol
Topological Polar Surface Area33 A^2
Heavy Atom Count15
Formal Charge0
Complexity255
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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138113-09-4
Agomelatine
Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.

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6836-19-7
Agomelatine
Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved ...
Beijing Lunarsun pharma is a professional manufacturer of API and intermediates. The factory is approved by US FDA. According to EU and US FDA's requirement, we supply following APIs and their intermediates with good quality and competitive price: Aztreonam,Doripenem, Dronedarone Hcl ,Erlotinib HCL, Febuxostat,Gemcitabine HCL, Ivabradine, Imatinib mesylate, Mecobalamin,Moxifloxacin, Nelarabine,Pemetrexed disodium, Posaconazole, Temozolomide, Voriconazole, Tebipenem pivoxil.NOTE: Products covered by valid patents in any country are not offered or supplied to these countries for commercial purpose.

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7-Methoxy-1 -naphthaleneacetic acid

Contact the Supplier
6836-22-2
Agomelatine
Hangzhou Longshine Bio-Tech CO., Ltd started in 2011, locating in Hangzhou, Zhejiang, China. We specially...
Hangzhou Longshine Bio-Tech CO., Ltd started in 2011, locating in Hangzhou, Zhejiang, China. We specially focus on servicing pharmaceutical and chemical goods, both export & Import. The Team includes Master of Biology, Chemists, pharmacists, and etc.

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7-Methoxy-1 -naphthylacetonitrile

Contact the Supplier
138113-08-3
Agomelatine
Hangzhou Longshine Bio-Tech CO., Ltd started in 2011, locating in Hangzhou, Zhejiang, China. We specially...
Hangzhou Longshine Bio-Tech CO., Ltd started in 2011, locating in Hangzhou, Zhejiang, China. We specially focus on servicing pharmaceutical and chemical goods, both export & Import. The Team includes Master of Biology, Chemists, pharmacists, and etc.

Virtual Booth Upgrade this company profile, update & customize all content// Ask PharmaCompass, click HERE

6836-19-7
Agomelatine
Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic Uni...
Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic University & Zhejiang University. We always focus on the market & customer needs, committee to researching, developing & marketing innovative products & services of pharmaceutical & health. Our Pharmaceutical Division: Committed to the R&D, promotion, distribution of APIs & intermediates, to provide various innovative products & technical solutions for China & global pharmaceutical markets. Our Health Division: Continuously tapping the natural active ingredients, combining traditional Chinese medicine theory, to develop functional foods.
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