| CAS Number | 1542209-30-2 |
| Catalog Number | AG01DUCT |
| Chemical Name | N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-2-carboxamide |
| IUPAC Name | N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-2-carboxamide |
| InChI | InChI=1S/C18H21BN2O3/c1-17(2)18(3,4)24-19(23-17)13-8-10-14(11-9-13)21-16(22)15-7-5-6-12-20-15/h5-12H,1-4H3,(H,21,22) |
| InChI Key | KOYMIJJSIGPVAA-UHFFFAOYSA-N |
| MDL Number | MFCD31916430 |
| Molecular Formula | C18H21BN2O3 |
| Molecular Weight | 324.1819 |
| SMILES | CC1(OB(OC1(C)C)C1=CC=C(C=C1)NC(C1=NC=CC=C1)=O)C |
| Synonyms | N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)picolinamide,
1542209-30-2,
KOYMIJJSIGPVAA-UHFFFAOYSA-N,
AS-55437,
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-2-carboxamide,
|
| Complexity | 445 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 324.164523g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 324.2g/mol |
| Monoisotopic Mass | 324.164523g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 60.4Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number