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Also known as: 58349-17-0, (s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine hydrochloride, (s)-(-)-5-methoxy-2-aminotetraline hydrochloride, (2s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine hydrochloride, (2s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride, 2-naphthalenamine, 1,2,3,4-tetrahydro-5-methoxy-, hydrochloride, (2s)-
Molecular Formula
C11H16ClNO
Molecular Weight
213.70  g/mol
InChI Key
CGLCAQWQPIFKRX-FVGYRXGTSA-N

CAS 58349-17-0
1 2D Structure

CAS 58349-17-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
2.1.2 InChI
InChI=1S/C11H15NO.ClH/c1-13-11-4-2-3-8-7-9(12)5-6-10(8)11;/h2-4,9H,5-7,12H2,1H3;1H/t9-;/m0./s1
2.1.3 InChI Key
CGLCAQWQPIFKRX-FVGYRXGTSA-N
2.1.4 Canonical SMILES
COC1=CC=CC2=C1CCC(C2)N.Cl
2.1.5 Isomeric SMILES
COC1=CC=CC2=C1CC[C@@H](C2)N.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 58349-17-0

2. (s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine Hydrochloride

3. (s)-(-)-5-methoxy-2-aminotetraline Hydrochloride

4. (2s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine Hydrochloride

5. (2s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride

6. 2-naphthalenamine, 1,2,3,4-tetrahydro-5-methoxy-, Hydrochloride, (2s)-

7. Schembl3468007

8. Dtxsid30483988

9. Bcp12379

10. Cs-m1827

11. Mfcd08443937

12. Akos015914933

13. Ss-4843

14. (2s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine--hydrogen Chloride (1/1)

15. Ac-26363

16. (s)-2-amino-5-methoxytetraline Hydrochloride

17. A24940

18. 349a170

19. (s)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine Hcl

20. (s)-5-methoxy-1,2,3,4-tetrahydro-naphthalen-2-ylamine Hydrochloride

21. (s)-2-amino-5-methoxytetrahydronaphthalene Hydrochloride;(s)-2-amino-5-methoxytetralin Hydrochloride;4-tetrahydro-5-methoxy-

2.3 Create Date
2007-02-07
3 Chemical and Physical Properties
Molecular Weight 213.70 g/mol
Molecular Formula C11H16ClNO
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass213.0920418 g/mol
Monoisotopic Mass213.0920418 g/mol
Topological Polar Surface Area35.2 Ų
Heavy Atom Count14
Formal Charge0
Complexity172
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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