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The molecular formula is C16H27BN2O5.
The synonyms are BCP23336, XSB94499, AKOS015891544, tert-Butyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-ylcarbamate.
The molecular weight is 338.2 g/mol.
The IUPAC name is (3-hydroxy-2,3-dimethylbutan-2-yl)oxy-[2-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]borinic acid.
The InChI is InChI=1S/C16H27BN2O5/c1-14(2,3)23-13(20)19-12-11(9-8-10-18-12)17(22)24-16(6,7)15(4,5)21/h8-10,21-22H,1-7H3,(H,18,19,20).
The InChIKey is UGHSVJXIYKOZSL-UHFFFAOYSA-N.
The Canonical SMILES is B(C1=C(N=CC=C1)NC(=O)OC(C)(C)C)(O)OC(C)(C)C(C)(C)O.
The hydrogen bond donor count is 3.
The hydrogen bond acceptor count is 6.
Yes, Boc-2-aminopyridine-3-boronic acid pinacol ester is a canonicalized compound.
196212-27-8
1054483-78-1
1072944-98-9
1072945-00-6
1160790-92-0
1073312-28-3
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