957060-76-3 Purity
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Specification
The molecular formula of 4-Benzyloxy-2-fluorophenylboronic acid is C13H12BFO3.
The molecular weight of 4-Benzyloxy-2-fluorophenylboronic acid is 246.04 g/mol.
The IUPAC name of 4-Benzyloxy-2-fluorophenylboronic acid is (2-fluoro-4-phenylmethoxyphenyl)boronic acid.
The InChI of 4-Benzyloxy-2-fluorophenylboronic acid is InChI=1S/C13H12BFO3/c15-13-8-11(6-7-12(13)14(16)17)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2.
The InChIKey of 4-Benzyloxy-2-fluorophenylboronic acid is PQWKGFALWCOVTC-UHFFFAOYSA-N.
4-Benzyloxy-2-fluorophenylboronic acid has 2 hydrogen bond donor counts.
The topological polar surface area of 4-Benzyloxy-2-fluorophenylboronic acid is 49.7 Ų.
4-Benzyloxy-2-fluorophenylboronic acid has 4 rotatable bond counts.
Yes, the compound is canonicalized.
The compound was created on 2005-07-19 and last modified on 2023-12-02.