| CAS Number | 689282-13-1 |
| Catalog Number | AG00IMF9(AGN-PC-0TU30Z) |
| Chemical Name | 1,1,2,2,3,3,4,4,4-Nonafluoro-N-[(1,1,2,2,3,3,4,4,4-nonafluorobutyl)sulfonyl]-1-butanesulfonamide calcium salt |
| IUPAC Name | calcium;bis(1,1,2,2,3,3,4,4,4-nonafluorobutylsulfonyl)azanide |
| InChI | InChI=1S/2C8F18NO4S2.Ca/c2*9-1(10,5(17,18)19)3(13,14)7(23,24)32(28,29)27-33(30,31)8(25,26)4(15,16)2(11,12)6(20,21)22;/q2*-1;+2 |
| InChI Key | WGPFQGXTGKSRPV-UHFFFAOYSA-N |
| MDL Number | MFCD30749257 |
| Molecular Formula | C16H2CaF36N2O8S4 |
| Molecular Weight | 1202.4762 |
| SMILES | O=S(NS(=O)(C(F)(C(F)(C(F)(C(F)(F)F)F)F)F)=O)(C(F)(C(F)(C(F)(C(F)(F)F)F)F)F)=O.O=S(NS(=O)(C(F)(C(F)(C(F)(C(F)(F)F)F)F)F)=O)(C(F)(C(F)(C(F)(C(F)(F)F)F)F)F)=O.[Ca] |
| Synonyms | Bis(nonafluorobutanesulfonyl)imide Calcium(II) Salt,
689282-13-1,
|
| Complexity | 1900 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 1199.759g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 67 |
| Hydrogen Bond Acceptor Count | 46 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 1200.443g/mol |
| Monoisotopic Mass | 1199.759g/mol |
| Rotatable Bond Count | 16 |
| Topological Polar Surface Area | 172A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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