| CAS Number | 1291068-40-0 |
| Catalog Number | AG00J0I2(AGN-PC-0WAY4W) |
| Chemical Name | Tetrabutylammonium 4-fluorophenyltrifluoroborate |
| IUPAC Name | tetrabutylazanium;trifluoro-(4-fluorophenyl)boranuide |
| InChI | InChI=1S/C16H36N.C6H4BF4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;8-6-3-1-5(2-4-6)7(9,10)11/h5-16H2,1-4H3;1-4H/q+1;-1 |
| InChI Key | LPZIMKAFBMJDQS-UHFFFAOYSA-N |
| MDL Number | MFCD28101518 |
| Molecular Formula | C22H40BF4N |
| Molecular Weight | 405.3643 |
| SMILES | FC1(=CC=C([B-](F)(F)F)C=C1).[N+](CCCC)(CCCC)(CCCC)CCCC |
| Synonyms | 1291068-40-0,
Tetrabutylammonium 4-fluorophenyltrifluoroborate,
tetrabutylazanium; trifluoro(4-fluorophenyl)boranuide,
KS-000022MM,
MFCD28101518,
AKOS030245847,
AS-3048,
PC210021,
Tetrabutylazanium; trifluoro-(4-fluorophenyl)boranuide,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 405.319g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 405.373g/mol |
| Monoisotopic Mass | 405.319g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number