| CAS Number | 2246771-83-3 |
| Catalog Number | AG01FPHK(AGN-PC-3H5OO5) |
| Chemical Name | Butanamide, N-[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3,3-dimethyl- |
| IUPAC Name | N-[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3,3-dimethylbutanamide |
| InChI | InChI=1S/C18H27BFNO3/c1-16(2,3)11-15(22)21-14-9-8-12(20)10-13(14)19-23-17(4,5)18(6,7)24-19/h8-10H,11H2,1-7H3,(H,21,22) |
| InChI Key | QDXWYASKKBWVHS-UHFFFAOYSA-N |
| MDL Number | MFCD32206554 |
| Molecular Formula | C18H27BFNO3 |
| Molecular Weight | 335.2213 |
| SMILES | FC1=CC(=C(C=C1)NC(CC(C)(C)C)=O)B1OC(C(O1)(C)C)(C)C |
| Synonyms | AS-74454,
2246771-83-3,
N-[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3,3-dimethylbutanamide,
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| Complexity | 459 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 335.206802g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 335.2g/mol |
| Monoisotopic Mass | 335.206802g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 47.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number