| CAS Number | 2246619-90-7 |
| Catalog Number | AG01FPU9(AGN-PC-3H5P5G) |
| Chemical Name | N-(2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propionamide |
| IUPAC Name | N-[2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanamide |
| InChI | InChI=1S/C16H24BNO4/c1-7-14(19)18-12-9-8-11(10-13(12)20-6)17-21-15(2,3)16(4,5)22-17/h8-10H,7H2,1-6H3,(H,18,19) |
| InChI Key | MJCBGQMMQKWEHI-UHFFFAOYSA-N |
| MDL Number | MFCD32206481 |
| Molecular Formula | C16H24BNO4 |
| Molecular Weight | 305.1771 |
| SMILES | COC1=C(C=CC(=C1)B1OC(C(O1)(C)C)(C)C)NC(CC)=O |
| Synonyms | AS-73624,
N-[2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanamide,
2246619-90-7,
|
| Complexity | 397 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.179838g/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 | 305.179838g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 56.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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