| CAS Number | 2246782-64-7 |
| Catalog Number | AG00RK8M(AGN-PC-3H4G2N) |
| Chemical Name | N-[4-fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropanecarboxamide |
| IUPAC Name | N-[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropanecarboxamide |
| InChI | InChI=1S/C16H21BFNO3/c1-15(2)16(3,4)22-17(21-15)12-9-11(18)7-8-13(12)19-14(20)10-5-6-10/h7-10H,5-6H2,1-4H3,(H,19,20) |
| InChI Key | ZAAWXOPPLOKQMR-UHFFFAOYSA-N |
| MDL Number | MFCD32206491 |
| Molecular Formula | C16H21BFNO3 |
| Molecular Weight | 305.1522 |
| SMILES | FC1=CC(B2OC(C)(C)C(C)(C)O2)=C(NC(C3CC3)=O)C=C1 |
| Synonyms | AS-73789,
N-[4-fluoro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropanecarboxamide,
2246782-64-7,
|
| Complexity | 437 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.159852g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 305.2g/mol |
| Monoisotopic Mass | 305.159852g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 47.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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