4229-44-1 Purity
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Specification
The molecular formula is C8F17SO2N(C2H5)CH2CH2OC(O)CH=CH2.
The molecular weight is 625.3 g/mol.
The IUPAC name is 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl prop-2-enoate.
The InChI is InChI=1S/C15H12F17NO4S/c1-3-7(34)37-6-5-33(4-2)38(35,36)15(31,32)13(26,27)11(22,23)9(18,19)8(16,17)10(20,21)12(24,25)14(28,29)30/h3H,1,4-6H2,2H3.
The InChIKey is ZAZJGBCGMUKZEL-UHFFFAOYSA-N.
The canonical SMILES is CCN(CCOC(=O)C=C)S(=O)(=O)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.
The CAS number is 423-82-5.
The UNII is 7L81F9QVY8.
The hydrogen bond acceptor count is 22.
The topological polar surface area is 72.1?2.