| CAS Number | 1323952-09-5 |
| Catalog Number | AG00HSN2(AGN-PC-0WNQV1) |
| Chemical Name | Potassium (3-carbamoylphenyl)trifluoroborate |
| IUPAC Name | potassium;(3-carbamoylphenyl)-trifluoroboranuide |
| InChI | InChI=1S/C7H6BF3NO.K/c9-8(10,11)6-3-1-2-5(4-6)7(12)13;/h1-4H,(H2,12,13);/q-1;+1 |
| InChI Key | NDWKAOLWSYUGOE-UHFFFAOYSA-N |
| MDL Number | MFCD09993284 |
| Molecular Formula | C7H6BF3KNO |
| Molecular Weight | 227.0331 |
| SMILES | F[B-](F)(C1=CC=CC(C(N)=O)=C1)F.[K+] |
| Synonyms | Potassium (3-carbamoylphenyl)trifluoroborate,
1323952-09-5,
AKOS026671031,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.013g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.035g/mol |
| Monoisotopic Mass | 227.013g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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