554411-20-0 Purity
96%
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The molecular formula is C13H17BN2O2.
The molecular weight is 244.10 g/mol.
The IUPAC name is 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[1,5-a]pyridine.
The InChI is InChI=1S/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)10-9-15-16-8-6-5-7-11(10)16/h5-9H,1-4H3.
The InChIKey is JAJULIZEUUBTGU-UHFFFAOYSA-N.
The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=C3C=CC=CN3N=C2.
The CAS number is 1207557-48-9.
The European Community (EC) number is 865-246-0.
The DSSTox Substance ID is DTXSID60729169.
Yes, Pyrazolo[1,5-a]pyridin-3-yl-boronic acid pinacol ester is a canonicalized compound.
Reference: [1]Patent: WO2010/17046,2010,A1 .Location in patent: Page/Page column 47; 126-127
Reference: [1] Tetrahedron, 2012, vol. 68, # 27-28, p. 5434 - 5444
Reference: [1]Patent: WO2010/17046,2010,A1 .Location in patent: Page/Page column 47; 127
Reference: [1]Patent: US2011/152273,2011,A1 .Location in patent: Page/Page column 51
* For details of the synthesis route, please refer to the original source to ensure accuracy.