208521-35-1 Purity
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The molecular formula is C11H17BN2O4.
The synonyms are 1356087-58-5, (6-((tert-Butoxycarbonyl)amino)-5-methylpyridin-3-yl)boronic acid, 2-tert-butyloxycarbonylamino-3-methylpyridine-5-boronic acid, [5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid, and (6-{[(tert-butoxy)carbonyl]amino}-5-methylpyridin-3-yl)boronic acid.
The compound was created on May 31, 2013.
The compound was last modified on December 2, 2023.
The IUPAC name is [5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid.
The InChI is InChI=1S/C11H17BN2O4/c1-7-5-8(12(16)17)6-13-9(7)14-10(15)18-11(2,3)4/h5-6,16-17H,1-4H3,(H,13,14,15).
The InChIKey is YEHXEJUMAMZEKC-UHFFFAOYSA-N.
The canonical SMILES is B(C1=CC(=C(N=C1)NC(=O)OC(C)(C)C)C)(O)O.
The molecular weight is 252.08 g/mol.
Yes, the compound is canonicalized.