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2D Structure
Also known as: 63675-74-1, 6-methoxy-2-(4-methoxyphenyl)-1-benzothiophene, 6-methoxy-2-(4-methoxyphenyl)benzobithiophene, 6-methoxy-2-(4-methoxyphenyl)benzothiophene, 6-methoxy-2-(4-methoxyphenyl)benzo(b)thiophene, 2-(4-methoxyphenyl)-6-methoxybenzo[b]thiophene
Molecular Formula
C16H14O2S
Molecular Weight
270.3  g/mol
InChI Key
HRWAGCVMOGWQJF-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
6-methoxy-2-(4-methoxyphenyl)-1-benzothiophene
2.1.2 InChI
InChI=1S/C16H14O2S/c1-17-13-6-3-11(4-7-13)15-9-12-5-8-14(18-2)10-16(12)19-15/h3-10H,1-2H3
2.1.3 InChI Key
HRWAGCVMOGWQJF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC=C(C=C1)C2=CC3=C(S2)C=C(C=C3)OC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 63675-74-1

2. 6-methoxy-2-(4-methoxyphenyl)-1-benzothiophene

3. 6-methoxy-2-(4-methoxyphenyl)benzobithiophene

4. 6-methoxy-2-(4-methoxyphenyl)benzothiophene

5. 6-methoxy-2-(4-methoxyphenyl)benzo(b)thiophene

6. 2-(4-methoxyphenyl)-6-methoxybenzo[b]thiophene

7. Benzo[b]thiophene, 6-methoxy-2-(4-methoxyphenyl)-

8. Mfcd02083138

9. 2-(4-methoxy Phenyl)-6-methoxy Benzo[b]thiophene

10. Einecs 264-408-2

11. Mls006011668

12. Schembl1665299

13. Dtxsid20213054

14. Zinc385624

15. Amy21951

16. Bcp08882

17. Akos005100762

18. 7m-358s

19. Cs-w009444

20. Smr002530445

21. Sy030955

22. 4-methoxyphenyl-6-methoxybenzo[b]thiophene

23. 2-(4-methoxyphenyl)-6-methoxybenzothiophene

24. A8762

25. Ft-0640902

26. M2345

27. F16241

28. 2-(4'-methoxyphenyl)-6-methoxybenzo[b]thiophene

29. 2-(4--methoxyphenyl)-6-methoxybenzo[b]thiophene

30. 2-(4-methoxyphenyl)-6-methoxy-1-benzothiophene

31. 6-methoxy-2-(4-methoxyphenyl)-benzo[b]thiophene

32. 6-methoxy-2-(4-methoxyphenyl)benzo [b]thiophene

33. 6-methoxy-2-(4-methoxyphenyl)benzo-[b]thiophene

34. 6-methoxy-2-(4-methoxyphenyl) -benzo[b]thiophene

35. 675m741

36. Sr-01000944931

37. 2-(4'-methoxyphenyl) - 6-methoxybenzo[b]thiophene

38. 6-methoxy-2-(4-methoxy-phenyl) -benzo[b]thiophene

39. Sr-01000944931-1

40. W-104887

41. 4-(6-methoxy-1-benzothiophen-2-yl)phenyl Methyl Ether

2.3 Create Date
2005-07-09
3 Chemical and Physical Properties
Molecular Weight 270.3 g/mol
Molecular Formula C16H14O2S
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass270.07145086 g/mol
Monoisotopic Mass270.07145086 g/mol
Topological Polar Surface Area46.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity289
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1