1451393-10-4 Purity
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The molecular formula of 1-Isoquinolylboronic acid is C9H8BNO2.
The molecular weight of 1-Isoquinolylboronic acid is 172.98 g/mol.
The IUPAC name of 1-Isoquinolylboronic acid is isoquinolin-1-ylboronic acid.
The InChI key of 1-Isoquinolylboronic acid is RVUIQFODKHOTHQ-UHFFFAOYSA-N.
The canonical SMILES of 1-Isoquinolylboronic acid is B(C1=NC=CC2=CC=CC=C12)(O)O.
1-Isoquinolylboronic acid has 2 hydrogen bond donor counts.
1-Isoquinolylboronic acid has 3 hydrogen bond acceptor counts.
1-Isoquinolylboronic acid has 1 rotatable bond count.
The topological polar surface area of 1-Isoquinolylboronic acid is 53.4Ų.
1-Isoquinolylboronic acid has 13 heavy atom counts.