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The molecular formula of 2-Ethoxy-4-methylpyridine-3-boronic acid is C8H12BNO3.
The IUPAC name of 2-Ethoxy-4-methylpyridine-3-boronic acid is (2-ethoxy-4-methylpyridin-3-yl)boronic acid.
The InChI of 2-Ethoxy-4-methylpyridine-3-boronic acid is InChI=1S/C8H12BNO3/c1-3-13-8-7(9(11)12)6(2)4-5-10-8/h4-5,11-12H,3H2,1-2H3.
The InChIKey of 2-Ethoxy-4-methylpyridine-3-boronic acid is RXEMDUDOXFSVOJ-UHFFFAOYSA-N.
The computed canonical SMILES of 2-Ethoxy-4-methylpyridine-3-boronic acid is B(C1=C(C=CN=C1OCC)C)(O)O.
The CAS number of 2-Ethoxy-4-methylpyridine-3-boronic acid is 1309982-61-3.
The molecular weight of 2-Ethoxy-4-methylpyridine-3-boronic acid is 181.00 g/mol.
There are 2 hydrogen bond donor counts in 2-Ethoxy-4-methylpyridine-3-boronic acid.
There are 4 hydrogen bond acceptor counts in 2-Ethoxy-4-methylpyridine-3-boronic acid.
The topological polar surface area of 2-Ethoxy-4-methylpyridine-3-boronic acid is 62.6Ų.
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