Bis(2-perfluorooctylethyl) phosphate ammonium salt

CAS Name

1-Decanol, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluoro-, 1-(dihydrogen phosphate), ammonium salt (1:1)

Molecular Formula

C₂₀H₉F₃₄O₄P.H₃N

Other Names and Identifiers

InChI

InChI=1S/C20H9F34O4P.H3N/c21-5(22,7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)17(45,46)19(49,50)51)1-3-57-59(55,56)58-4-2-6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(43,44)18(47,48)20(52,53)54;/h1-4H2,(H,55,56);1H3

InChIKey

InChIKey=JNZVTKOEMWLMOF-UHFFFAOYSA-N

SMILES

C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(CCOP(OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(=O)O)(F)F)(F)F)(F)F)(F)F.N

Canonical SMILES

O=P(O)(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.N

Other Names for this Substance