CAS 33100-27-5

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Also known as: 15-crown-5, 33100-27-5, 15-crown-5 ether, 15-crown 5-ether, 1,4,10,13-pentaoxacyclopentadecane, Mfcd00005110

Molecular Formula

C₁₀H₂₀O₅

Molecular Weight

220.26 g/mol

InChI Key

VFTFKUDGYRBSAL-UHFFFAOYSA-N

1 2D Structure

CAS 33100-27-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1,4,7,10,13-pentaoxacyclopentadecane

2.1.2 InChI

InChI=1S/C10H20O5/c1-2-12-5-6-14-9-10-15-8-7-13-4-3-11-1/h1-10H2

2.1.3 InChI Key

VFTFKUDGYRBSAL-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1COCCOCCOCCOCCO1

2.2 Synonyms

2.2.1 MeSH Synonyms

1. 15-crown-5

2.2.2 Depositor-Supplied Synonyms

1. 15-crown-5

2. 33100-27-5

3. 15-crown-5 Ether

4. 15-crown 5-ether

5. 1,4,10,13-pentaoxacyclopentadecane

6. Mfcd00005110

7. Chebi:32401

8. Ccris 3586

9. Einecs 251-379-6

10. Brn 1618144

11. 15-crown-5(1,4,7,10,13-pentaoxacyclopentadecane)

12. 15-crown 5

13. [15]crown-5

14. 8-phenyloctanoicacid

15. Schembl78595

16. 5-19-12-00252 (beilstein Handbook Reference)

17. 15-crown-5, 98%

18. Chembl156289

19. Dtxsid7067746

20. Act02859

21. Amy25644

22. Bcp24526

23. Zinc3861363

24. Bbl011088

25. Stk802309

26. 15-crown-5 Solution, 1 M In Thf

27. Akos005622525

28. 1,4,7,1,13-pentaoxacyclopentadecane

29. Cs-w007451

30. 1,4,7,10,13pentaoxa-cyclopentadecane

31. 1,4,7,10,13-pentaoxa-cyclopentadecane

32. 15c5

33. Sy009952

34. 15-crown-5, Purum, >=98.0% (gc)

35. Ft-0607243

36. 1, 4, 7, 10, 13-pentaoxacyclopentadecane

37. 15-crown-5, Vetec(tm) Reagent Grade, 98%

38. 100c275

39. A821622

40. J-503959

41. Q4550134

42. 10caf7bc-91ec-44df-a9eb-501ea2c83e15

43. Eyo

2.3 Create Date

2004-09-16

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₂₀O₅
Molecular Weight	220.26 g/mol
XLogP3	-0.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	220.13107373 g/mol
Monoisotopic Mass	220.13107373 g/mol
Topological Polar Surface Area	46.2 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	86.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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