| CAS Number | 1001671-72-2 |
| Catalog Number | AG00IMJY(AGN-PC-0WQUOL) |
| Chemical Name | Potassium (Phthalimidomethyl)Trifluoroborate |
| IUPAC Name | potassium;(1,3-dioxoisoindol-2-yl)methyl-trifluoroboranuide |
| InChI | InChI=1S/C9H6BF3NO2.K/c11-10(12,13)5-14-8(15)6-3-1-2-4-7(6)9(14)16;/h1-4H,5H2;/q-1;+1 |
| InChI Key | WDVWKFFRDCGKDS-UHFFFAOYSA-N |
| MDL Number | MFCD19000584 |
| Molecular Formula | C9H6BF3KNO2 |
| Molecular Weight | 267.0539 |
| SMILES | O=C2N(C[B-](F)(F)F)C(C1=CC=CC=C12)=O.[K+] |
| Synonyms | Potassium ((1,3-dioxoisoindolin-2-yl)methyl)trifluoroborate,
1001671-72-2,
AKOS013013939,
Potassium (Phthalimidomethyl)trifluoroborate,
P2514,
|
| Complexity | 313 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.056g/mol |
| Monoisotopic Mass | 267.008g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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