196597-80-5

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Also known as: 196597-80-5, (s)-2-(2,6,7,8-tetrahydro-1h-indeno[5,4-b]furan-8-yl)ethanamine (hydrochloride), (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl)ethan-1-amine hydrochloride, (s)-2-(2,6,7,8-tetrahydro-1h-indeno[5,4-b]furan-8-yl)ethanamine hydrochloride, 2-[(8s)-2,6,7,8-tetrahydro-1h-cyclopenta[e][1]benzofuran-8-yl]ethanamine;hydrochloride, (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl)ethylamine hydrochloride

Molecular Formula

C₁₃H₁₈ClNO

Molecular Weight

239.74 g/mol

InChI Key

PTRBVFJPGFTDDU-PPHPATTJSA-N

1 2D Structure

196597-80-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-[(8S)-2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-yl]ethanamine;hydrochloride

2.1.2 InChI

InChI=1S/C13H17NO.ClH/c14-7-5-10-2-1-9-3-4-12-11(13(9)10)6-8-15-12;/h3-4,10H,1-2,5-8,14H2;1H/t10-;/m0./s1

2.1.3 InChI Key

PTRBVFJPGFTDDU-PPHPATTJSA-N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 196597-80-5

2. (s)-2-(2,6,7,8-tetrahydro-1h-indeno[5,4-b]furan-8-yl)ethanamine (hydrochloride)

3. (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl)ethan-1-amine Hydrochloride

4. (s)-2-(2,6,7,8-tetrahydro-1h-indeno[5,4-b]furan-8-yl)ethanamine Hydrochloride

5. 2-[(8s)-2,6,7,8-tetrahydro-1h-cyclopenta[e][1]benzofuran-8-yl]ethanamine;hydrochloride

6. (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl)ethylamine Hydrochloride

7. 1,2,6,7-tetrahydro-3-oxa-as-indacen-8-one

8. (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl) Ethylamine Hydrochloride

9. (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl] Ethylamine Hydrochloride

10. Mfcd09955089

11. Schembl339855

12. (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8yl)ethylamine Hydrochloride

13. (s)-2-[1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl]ethylamine Hydrochloride

14. Ptrbvfjpgftddu-pphpattjsa-n

15. Dtxsid001335307

16. Cs-m0090

17. Ac-777

18. (s)-2-(2,6,7,8-tetrahydro-1h-indeno[5,4-b]furan-8-yl)ethanamine Hcl

19. Akos025402288

20. Cs-14171

21. Db-115657

22. (s)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl)ethan-1-aminehydrochloride

23. 2-[(8s)-1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl]ethanamine Hydrochloride (1:1)

24. 2-[(8s)-1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl]ethanamine Hydrochloride Salt

25. 2-[(8s)-2,6,7,8-tetrahydro-1h-cyclopenta[e]benzofuran-8-yl]ethanamine;hydrochloride

2.3 Create Date

2010-05-14

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₈ClNO
Molecular Weight	239.74 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	35.3
Heavy Atom Count	16
Formal Charge	0
Complexity	231
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

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