Mono[2-(perfluorodecyl)ethyl] Sulfate Potassium Salt - CAS 1262446-14-9

Catalog:	BB059005
Product Name:	Mono[2-(perfluorodecyl)ethyl] Sulfate Potassium Salt
CAS:	1262446-14-9
Synonyms:	3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Heneicosafluoro-1-dodecanol 1-(Hydrogen Sulfate) Potassium Salt; 10:2 FTOH Sulfate Potassium Salt

Technical Data

IUPAC Name:	potassium3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecan-1-olsulfoazanide
Description:	Mono[2-(perfluorodecyl)ethyl] Sulfate is the sulfate conjugate of 8-2 Fluorotelomer Alcohol, a raw material used in the manufacturing of fluorotelomer-based products
Molecular Weight:	682.29
Molecular Formula:	C12H4F21KO4S
Canonical SMILES:	C([CH-]O)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[NH-]S(=O)(=O)O.[K+]
InChI:	InChI=1S/C12H4F21O.K.H2NO3S/c13-3(14,1-2-34)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)11(29,30)12(31,32)331-5(2,3)4/h2,34H,1H2(H2-,1,2,3,4)/q-1+1-1
InChI Key:	XLMPWRSAIDEYDM-UHFFFAOYSA-N
References:	Paterova, J. et al. J. Fluor. Chem., 131, 1338 (2010).

Complexity:	958
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	3
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	697.9319267
Formal Charge:	-1
Heavy Atom Count:	40
Hydrogen Bond Acceptor Count:	27
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	697.9319267
Rotatable Bond Count:	10
Topological Polar Surface Area:	84Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0