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CAS 274693-55-9 manufacturers and suppliers on PharmaCompass

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CAS 274693-55-9
Also known as: 274693-55-9, 2-[[(3ar,4s,6r,6as)-6-aminotetrahydro-2,2-dimethyl-4h-cyclopenta-1,3-dioxol-4-yl]oxy]ethanol, 2-[[(3ar,4s,6r,6as)-6-amino-2,2-dimethyl-4,5,6,6a-tetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol, 1423768-25-5, 2-{[(3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yl]oxy}ethanol, Mfcd16875500
Molecular Formula
C10H19NO4
Molecular Weight
217.26  g/mol
InChI Key
WNYYMPICYAOQAE-RYPBNFRJSA-N

1 2D Structure

CAS 274693-55-9

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[[(3aR,4S,6R,6aS)-6-amino-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol
2.1.2 InChI
InChI=1S/C10H19NO4/c1-10(2)14-8-6(11)5-7(9(8)15-10)13-4-3-12/h6-9,12H,3-5,11H2,1-2H3/t6-,7+,8+,9-/m1/s1
2.1.3 InChI Key
WNYYMPICYAOQAE-RYPBNFRJSA-N
2.1.4 Canonical SMILES
CC1(OC2C(CC(C2O1)OCCO)N)C
2.1.5 Isomeric SMILES
CC1(O[C@H]2[C@@H](C[C@@H]([C@H]2O1)OCCO)N)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 274693-55-9

2. 2-[[(3ar,4s,6r,6as)-6-aminotetrahydro-2,2-dimethyl-4h-cyclopenta-1,3-dioxol-4-yl]oxy]ethanol

3. 2-[[(3ar,4s,6r,6as)-6-amino-2,2-dimethyl-4,5,6,6a-tetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol

4. 1423768-25-5

5. 2-{[(3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yl]oxy}ethanol

6. Mfcd16875500

7. 2-((3ar,4s,6r,6as)-6-amino-2,2-dimethyl-tetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yloxy)ethanol

8. 2-[[(3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]-dioxol-4-yl]oxy]-1-ethanol

9. Rel-2-(((3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethanol

10. Ticagrelor Intermediate1

11. Amot0085

12. Schembl1834548

13. Ticagrelor Related Compound 87

14. Dtxsid40433136

15. Zinc72194457

16. Akos015951194

17. Ex-7176

18. 2-((3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yloxy)ethanol

19. Ac-28727

20. Ds-13962

21. Ethanol, 2-[[(3ar,4s,6r,6as)-6-aminotetrahydro-2,2-dimethyl-4h-cyclopenta-1,3-dioxol-4-yl]oxy]-

22. Db-067793

23. Am20090744

24. Cs-0055080

25. D82263

26. P11947

27. A846828

28. J-506153

29. 2-(6-amino-2,2-dimethyl-tetrahydro-cyclopenta[1,3]dioxol-4-yloxy)-ethanol

30. (3 As,4r,6s,6ar)-6-(2-hydroxyethoxy)-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-amine

31. [(1r,5s,6r,8s)-8-(2-hydroxyethoxy)-3,3-dimethyl-2,4-dioxabicyclo[3.3.0]octane-6-yl]amine

32. 2-((3 Ar,4s,6r,6as)-6-amino-2,2-dimethyl-tetrahydro-3 Ah-cyclopenta[d][1,3]dioxol-4-yloxy)ethanol

33. 2-((3ar,4s,6r,6as)-6-amino-2,2-dimethyl-tetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yloxy)ethanol;2-(((3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-3ah-cyclopenta[d][1,3]dioxol-4-yl)oxy)ethanol

34. 2-{[(3ar,4s,6r,6as)-6-amino-2,2-dimethyltetrahydro-2h,3ah-cyclopenta[d][1,3]dioxol-4-yl]oxy}ethan-1-ol

35. Rel-2-[[(3ar,4s,6r,6as)-6-aminotetrahydro-2,2-dimethyl-4h-cyclopenta-1,3-dioxol-4-yl]oxy]ethanol

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 217.26 g/mol
Molecular Formula C10H19NO4
XLogP3-1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass217.13140809 g/mol
Monoisotopic Mass217.13140809 g/mol
Topological Polar Surface Area73.9 Ų
Heavy Atom Count15
Formal Charge0
Complexity234
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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