CAS 10272-07-8

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Also known as: 10272-07-8, Benzenamine, 3,5-dimethoxy-, 3,5-dimethoxybenzeneamine, 5-aminoresorcinol dimethyl ether, 3,5-dimethoxy-phenylamine, 3,5-dimethoxybenzenamine

Molecular Formula

C₈H₁₁NO₂

Molecular Weight

153.18 g/mol

InChI Key

WNRGWPVJGDABME-UHFFFAOYSA-N

FDA UNII

JS9DUH84WG

1 2D Structure

CAS 10272-07-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3,5-dimethoxyaniline

2.1.2 InChI

InChI=1S/C8H11NO2/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5H,9H2,1-2H3

2.1.3 InChI Key

WNRGWPVJGDABME-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COC1=CC(=CC(=C1)N)OC

2.2 Other Identifiers

2.2.1 UNII

JS9DUH84WG

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 10272-07-8

2. Benzenamine, 3,5-dimethoxy-

3. 3,5-dimethoxybenzeneamine

4. 5-aminoresorcinol Dimethyl Ether

5. 3,5-dimethoxy-phenylamine

6. 3,5-dimethoxybenzenamine

7. 5-aminoresorcinol Dimethylether

8. Mfcd00008392

9. Js9duh84wg

10. 3,5-dimethoxyanaline

11. 3,5-dimethoxy Aniline

12. Einecs 233-616-5

13. 3,5-dimethoxylaniline

14. 3,5-dimethoxy Analine

15. 3,5-dimethoxy-aniline

16. 3,5 Dimethoxy-aniline

17. 3.5-dimethoxybenzenamine

18. Unii-js9duh84wg

19. 3,5-dimethoxy-benzenamine

20. 3,5-dimethoxyaniline, 98%

21. Schembl116606

22. Dtxsid0065018

23. Chebi:172328

24. Zinc164493

25. Act00133

26. Cs-b0774

27. Stl168344

28. Akos000119595

29. Ac-2497

30. As-12377

31. Sy001674

32. Db-014224

33. Am20020107

34. D1484

35. Ft-0620026

36. A19805

37. 272d078

38. W-108865

39. F5608-0063

40. Z1245635764

2.4 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₁NO₂
Molecular Weight	153.18 g/mol
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	153.078978594 g/mol
Monoisotopic Mass	153.078978594 g/mol
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	107
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