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CAS 312753-53-0 manufacturers and suppliers on PharmaCompass

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4CH-011619
Also known as: 312753-53-0, 5,6-diethylindan-1-one, 5,6-diethyl-2,3-dihydro-1h-inden-2-amine;hydrochloride, 5,6-diethyl-2,3-dihydro-1h-inden-2-amine, hcl, Mfcd13185940, 2-amino-5,6-diethyl-2,3-dihydro-1h-indene hcl
Molecular Formula
C13H20ClN
Molecular Weight
225.76  g/mol
InChI Key
ZOVIYWYFBOQKIA-UHFFFAOYSA-N

1 2D Structure

4CH-011619

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5,6-diethyl-2,3-dihydro-1H-inden-2-amine;hydrochloride
2.1.2 InChI
InChI=1S/C13H19N.ClH/c1-3-9-5-11-7-13(14)8-12(11)6-10(9)4-2;/h5-6,13H,3-4,7-8,14H2,1-2H3;1H
2.1.3 InChI Key
ZOVIYWYFBOQKIA-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCC1=C(C=C2CC(CC2=C1)N)CC.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 312753-53-0

2. 5,6-diethylindan-1-one

3. 5,6-diethyl-2,3-dihydro-1h-inden-2-amine;hydrochloride

4. 5,6-diethyl-2,3-dihydro-1h-inden-2-amine, Hcl

5. Mfcd13185940

6. 2-amino-5,6-diethyl-2,3-dihydro-1h-indene Hcl

7. 2-amino-5,6-diethylindane Hydrochloride

8. Schembl866127

9. 5,6-diethyl-2,3-dihydro-1h-inden-2-aminehydrochloride

10. Dtxsid30437042

11. Bcp04728

12. Akos015924667

13. Cs-w020205

14. Sb18035

15. Ac-24698

16. Da-18293

17. Ds-17728

18. Sy107784

19. 5,6-diethyl-indan-2-ylamine Hydrochloride

20. Ft-0686954

21. 5,6-diethyl-2,3-dihydro-1h-inden-2-amine Hcl

22. 753d530

23. A846477

24. J-516521

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 225.76 g/mol
Molecular Formula C13H20ClN
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass225.1284273 g/mol
Monoisotopic Mass225.1284273 g/mol
Topological Polar Surface Area26 Ų
Heavy Atom Count15
Formal Charge0
Complexity170
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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