CAS 196597-81-6

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8 Related Intermediates

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Also known as: 196597-81-6, (s)-2-(2,6,7,8-tetrahydro-1h-indeno[5,4-b]furan-8-yl)ethanamine, Scw5cb6zzw, 2-[(8s)-2,6,7,8-tetrahydro-1h-cyclopenta[e][1]benzofuran-8-yl]ethanamine, (8s)-1,6,7,8-tetrahydro-2h-indeno(5,4-b)furan-8-ethanamine, Despropionyl ramelteon

Molecular Formula

C₁₃H₁₇NO

Molecular Weight

203.28 g/mol

InChI Key

BFNUHWYOQCGTCA-JTQLQIEISA-N

FDA UNII

SCW5CB6ZZW

1 2D Structure

CAS 196597-81-6

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

2.1.2 InChI

InChI=1S/C13H17NO/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/t10-/m0/s1

2.1.3 InChI Key

BFNUHWYOQCGTCA-JTQLQIEISA-N

2.2 Other Identifiers

2.2.1 UNII

SCW5CB6ZZW

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 196597-81-6

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

3. Scw5cb6zzw

4. 2-[(8s)-2,6,7,8-tetrahydro-1h-cyclopenta[e][1]benzofuran-8-yl]ethanamine

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

6. Despropionyl Ramelteon

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

8. Unii-scw5cb6zzw

9. Schembl340075

10. Bfnuhwyoqcgtca-jtqlqieisa-n

11. Dtxsid601194448

12. Akos015901673

13. Ac-27742

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

15. 2-[(8s)-1,6,7,8-tetrahydro-2h-indeno[5,4-b]furan-8-yl]ethanamine

16. 2h-indeno(5,4-b)furan-8-ethanamine, 1,6,7,8-tetrahydro-, (8s)-

17. S)-2-(1,6,7,8-tetrahydro-2h-indeno[5,4- B]furan-8-yl)ethylamine

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₇NO
Molecular Weight	203.28 g/mol
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	35.3
Heavy Atom Count	15
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	1