| CAS Number | 1059624-23-5 |
| Catalog Number | AG00IMCK(AGN-PC-0WQUJB) |
| Chemical Name | 1-Allyl-1-Methylpyrrolidinium Bis(Trifluoromethanesulfonyl)Imide |
| IUPAC Name | bis(trifluoromethylsulfonyl)azanide;1-methyl-1-prop-2-enylpyrrolidin-1-ium |
| InChI | InChI=1S/C8H16N.C2F6NO4S2/c1-3-6-9(2)7-4-5-8-9;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3H,1,4-8H2,2H3;/q+1;-1 |
| InChI Key | RXYDHDCXRMFQBC-UHFFFAOYSA-N |
| MDL Number | MFCD30749130 |
| Molecular Formula | C10H16F6N2O4S2 |
| Molecular Weight | 406.3655 |
| SMILES | C[N+]1(CC=C)CCCC1.FC(F)(S([N-]S(C(F)(F)F)(=O)=O)(=O)=O)F |
| Synonyms | 1-Allyl-1-methylpyrrolidinium Bis(trifluoromethanesulfonyl)imide,
1059624-23-5,
N-allyl-N-methylpyrrolidinium bis(trifluoromethylsulfonyl)amide,
A3089,
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| Complexity | 475 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 406.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 11 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 406.358g/mol |
| Monoisotopic Mass | 406.046g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 86A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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