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Technical details about Dicetylphosphate, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
Also known as: Dicetyl phosphate, Dihexadecyl phosphate, 2197-63-9, Dicetylphosphate, Dicetylphosphoric acid, Dicetyl hydrogen phosphate
Molecular Formula
C32H67O4P
Molecular Weight
546.8  g/mol
InChI Key
RNPXCFINMKSQPQ-UHFFFAOYSA-N
FDA UNII
2V6E5WN99N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
dihexadecyl hydrogen phosphate
2.1.2 InChI
InChI=1S/C32H67O4P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-37(33,34)36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3,(H,33,34)
2.1.3 InChI Key
RNPXCFINMKSQPQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCC
2.2 Other Identifiers
2.2.1 UNII
2V6E5WN99N
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Dicetyl Phosphate

2. Dicetylphosphate

3. Dicetylphosphate Potassium Salt

4. Dihexadecyl Phosphate

2.3.2 Depositor-Supplied Synonyms

1. Dicetyl Phosphate

2. Dihexadecyl Phosphate

3. 2197-63-9

4. Dicetylphosphate

5. Dicetylphosphoric Acid

6. Dicetyl Hydrogen Phosphate

7. 1-hexadecanol, Hydrogen Phosphate

8. Bis(hexadecyl) Phosphate

9. Di-n-hexadecyl Phosphate

10. Dipalmityl Phosphate

11. Phosphoric Acid Dihexadecyl Ester

12. Dipalmityl Hydrogen Phosphate

13. 1-hexadecanol Hydrogen Phosphate

14. 1-hexadecanol,1,1'-(hydrogen Phosphate)

15. 2v6e5wn99n

16. Chebi:60424

17. Nsc-12429

18. Phosphoric Acid, Dihexadecyl Ester

19. Einecs 218-594-7

20. Mfcd00008999

21. Nsc 12429

22. Brn 1717117

23. Dhp, Dicetyl Phosphate

24. Epitope Id:156812

25. Unii-2v6e5wn99n

26. Schembl64861

27. Bis(hexadecyloxy)phosphinic Acid

28. Dicetyl Phosphate [inci]

29. Dtxsid7062243

30. Rnpxcfinmksqpq-uhfffaoysa-

31. Amy7721

32. Bcp32676

33. Caa19763

34. Nsc12429

35. Zinc6920414

36. Akos015903310

37. Dicetyl Phosphate;dihexadecyl Phosphate

38. As-60121

39. 1-hexadecanol, 1,1'-(hydrogen Phosphate)

40. Db-045740

41. Cs-0152189

42. Ft-0634112

43. Dicetyl Phosphate, Dihexadecyl Phosphate, Powder

44. A878841

45. J-014386

46. Q27127272

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 546.8 g/mol
Molecular Formula C32H67O4P
XLogP314.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count32
Exact Mass546.47769761 g/mol
Monoisotopic Mass546.47769761 g/mol
Topological Polar Surface Area55.8 Ų
Heavy Atom Count37
Formal Charge0
Complexity434
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1