| CAS Number | 2093041-45-1 |
| Catalog Number | AG01FPUW(AGN-PC-3H5P62) |
| Chemical Name | N,N-diisopropyl-2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide |
| IUPAC Name | 2-methyl-N,N-di(propan-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide |
| InChI | InChI=1S/C20H32BNO3/c1-13(2)22(14(3)4)18(23)17-11-10-16(12-15(17)5)21-24-19(6,7)20(8,9)25-21/h10-14H,1-9H3 |
| InChI Key | YDIZZQOFNTVTQZ-UHFFFAOYSA-N |
| MDL Number | MFCD32206495 |
| Molecular Formula | C20H32BNO3 |
| Molecular Weight | 345.2840 |
| SMILES | CC1(C)OB(OC1(C)C)C2=CC=C(C(N(C(C)C)C(C)C)=O)C(C)=C2 |
| Synonyms | AS-73796,
2-methyl-N,N-bis(propan-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide,
2093041-45-1,
|
| Complexity | 465 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 345.247524g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 345.3g/mol |
| Monoisotopic Mass | 345.247524g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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