| CAS Number | 2093041-44-0 |
| Catalog Number | AG01FPVD(AGN-PC-3H5P6C) |
| Chemical Name | N,N-diethyl-2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide |
| IUPAC Name | N,N-diethyl-2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide |
| InChI | InChI=1S/C18H28BNO3/c1-8-20(9-2)16(21)15-11-10-14(12-13(15)3)19-22-17(4,5)18(6,7)23-19/h10-12H,8-9H2,1-7H3 |
| InChI Key | MRUNCJHTKMQTBM-UHFFFAOYSA-N |
| MDL Number | MFCD32206472 |
| Molecular Formula | C18H28BNO3 |
| Molecular Weight | 317.2308 |
| SMILES | O=C(N(CC)CC)C1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1C |
| Synonyms | AS-73446,
J3.530.736B,
N,N-diethyl-2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide,
N,N-Diethyl-o-methyl-p-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)benzamide,
2093041-44-0,
|
| Complexity | 418 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 317.216224g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 317.2g/mol |
| Monoisotopic Mass | 317.216224g/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
Lot Number