| CAS Number | 844501-35-5 |
| Catalog Number | AG01EHXR(AGN-PC-0UROQR) |
| Chemical Name | N-(3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide |
| IUPAC Name | N-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide |
| InChI | InChI=1S/C14H19BFNO3/c1-9(18)17-10-6-7-11(12(16)8-10)15-19-13(2,3)14(4,5)20-15/h6-8H,1-5H3,(H,17,18) |
| InChI Key | SRPPQFZYSXJEHE-UHFFFAOYSA-N |
| MDL Number | MFCD22494238 |
| Molecular Formula | C14H19BFNO3 |
| Molecular Weight | 279.1150 |
| SMILES | CC(NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C(F)=C1)=O |
| Synonyms | 844501-35-5,
N-(3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide,
N-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide,
SCHEMBL5918956,
AS-55463,
4-Acetamido-2-fluorophenylboronic acid, pinacol ester,
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| Complexity | 373 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.144g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.118g/mol |
| Monoisotopic Mass | 279.144g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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