| CAS Number | 2797-28-6 |
| Catalog Number | AG00BDXA(AGN-PC-0R3M6K) |
| Chemical Name | Lithium tetrakis(pentafluorophenyl)borate |
| IUPAC Name | lithium;ethoxyethane;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide |
| InChI | InChI=1S/C24BF20.2C4H10O.Li/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;2*1-3-5-4-2;/h;2*3-4H2,1-2H3;/q-1;;;+1 |
| InChI Key | DFEYNSJPQHLZSP-UHFFFAOYSA-N |
| MDL Number | MFCD01861289 |
| Molecular Formula | C24BF20Li |
| Molecular Weight | 685.9769 |
| SMILES | FC1=C(C(=C(C(=C1[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C1=C(C(=C(C(=C1F)F)F)F)F)C1=C(C(=C(C(=C1F)F)F)F)F)F)F)F)F.[Li+] |
| Synonyms | Borate(1-),tetrakis(pentafluorophenyl)-, lithium (1:1),
Lithium tetrakis(pentafluorophenyl)borate-ethyl ether complex,
2797-28-6,
|
| Complexity | 826 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 834.14g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 56 |
| Hydrogen Bond Acceptor Count | 23 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 834.228g/mol |
| Monoisotopic Mass | 834.14g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number