1443112-49-9 Purity
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The molecular formula of the compound is C16H23BO5.
The IUPAC name of the compound is ethyl 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]acetate.
The InChI of the compound is InChI=1S/C16H23BO5/c1-6-19-14(18)11-20-13-9-7-12(8-10-13)17-21-15(2,3)16(4,5)22-17/h7-10H,6,11H2,1-5H3.
The InChIKey of the compound is IWVRBFCAALMWBP-UHFFFAOYSA-N.
The canonical SMILES of the compound is B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OCC(=O)OCC.
The CAS number of the compound is 269410-28-8.
The molecular weight of the compound is 306.2 g/mol.
The compound has 0 hydrogen bond donor counts.
The compound has 5 hydrogen bond acceptor counts.
The compound has 6 rotatable bond counts.