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Technical details about Hexadecan-1-Ol; 2-Methyloxirane; Oxirane, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 37311-01-6, 9087-53-0, Hexadecan-1-ol;2-methyloxirane;oxirane, Polyoxyethylene (20) polyoxypropylene (4) cetyl ether, Ppg-4-ceteth-20, Triglyceryl beeswax
Molecular Formula
C21H44O3
Molecular Weight
344.6  g/mol
InChI Key
GTABBGRXERZUAH-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
hexadecan-1-ol;2-methyloxirane;oxirane
2.1.2 InChI
InChI=1S/C16H34O.C3H6O.C2H4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;1-3-2-4-3;1-2-3-1/h17H,2-16H2,1H3;3H,2H2,1H3;1-2H2
2.1.3 InChI Key
GTABBGRXERZUAH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCCCCCCCCCCCCCCCO.CC1CO1.C1CO1
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 37311-01-6

2. 9087-53-0

3. Hexadecan-1-ol;2-methyloxirane;oxirane

4. Polyoxyethylene (20) Polyoxypropylene (4) Cetyl Ether

5. Ppg-4-ceteth-20

6. Triglyceryl Beeswax

7. Oxyethylated, Oxypropylated Hexadecanol

8. Oxirane, Methyl-, Polymer With Oxirane, Hexadecyl Ether

9. Ppg-1-ceteth-5

10. Ppg-2-ceteth-1

11. Ppg-2-ceteth-5

12. Ppg-4-ceteth-5

13. Ppg-8-ceteth-2

14. Ppg-1-ceteth-20

15. Ppg-4-ceteth-10

16. Ppg-5 Ceteth-20

17. Ppg-5-ceteth-20

18. Ppg-8-ceteth-10

19. Ppg-8-ceteth-20

20. Schembl285156

21. Polyoxyethylene (10) Polyoxypropylene (4) Cetyl Ether

22. Oxirane, 2-methyl-, Polymer With Oxirane, Hexadecyl Ether

23. Oxirane, Methyl-, Polymer With Oxirane, Monohexadecyl Ether

24. Cetyl Alcohol, Ethoxylated, Propoxylated

25. Polyethylene - Polypropylene Glycol Hexadecyl Ether

26. Polyoxyethylene (1) Polyoxypropylene (2) Cetyl Ether

27. Polyoxyethylene (10) Polyoxypropylene (8) Cetyl Ether

28. Polyoxyethylene (2) Polyoxypropylene (8) Cetyl Ether

29. Polyoxyethylene (20) Polyoxypropylene (1) Cetyl Ether

30. Polyoxyethylene (20) Polyoxypropylene (5) Cetyl Ether

31. Polyoxyethylene (20) Polyoxypropylene (8) Cetyl Ether

32. Polyoxyethylene (5) Polyoxypropylene (1) Cetyl Ether

33. Polyoxyethylene (5) Polyoxypropylene (2) Cetyl Ether

34. Polyoxyethylene (5) Polyoxypropylene (4) Cetyl Ether

35. Polyoxypropylene (1) Polyoxyethylene (20) Cetyl Ether

36. Polyoxypropylene (1) Polyoxyethylene (5) Cetyl Ether

37. Polyoxypropylene (2) Polyoxyethylene (1) Cetyl Ether

38. Polyoxypropylene (2) Polyoxyethylene (5) Cetyl Ether

39. Polyoxypropylene (4) Polyoxyethylene (10) Cetyl Ether

40. Polyoxypropylene (4) Polyoxyethylene (20) Cetyl Ether

41. Polyoxypropylene (4) Polyoxyethylene (5) Cetyl Ether

42. Polyoxypropylene (5) Polyoxyethylene (20) Cetyl Ether

43. Polyoxypropylene (8) Polyoxyethylene (10) Cetyl Ether

44. Polyoxypropylene (8) Polyoxyethylene (2) Cetyl Ether

45. Polyoxypropylene (8) Polyoxyethylene (20) Cetyl Ether

2.3 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 344.6 g/mol
Molecular Formula C21H44O3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count14
Exact Mass344.32904526 g/mol
Monoisotopic Mass344.32904526 g/mol
Topological Polar Surface Area45.3 Ų
Heavy Atom Count24
Formal Charge0
Complexity159
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3
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