128312-11-8 Purity
97%
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The molecular formula of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is C8H9BClFO4.
The molecular weight of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is 234.42 g/mol.
The IUPAC name of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is computed by Lexichem TK 2.7.0.
The InChI of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is InChI=1S/C8H9BClFO4/c1-14-4-15-6-3-2-5(11)7(8(6)10)9(12)13/h2-3,12-13H,4H2,1H3.
The InChIKey of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is HEHSNQNHNZDAGM-UHFFFAOYSA-N.
The canonical SMILES of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is B(C1=C(C=CC(=C1Cl)OCOC)F)(O)O.
The CAS number of 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid is 1451392-26-9.
There are 2 hydrogen bond donor counts in 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid.
There are 5 hydrogen bond acceptor counts in 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid.
There are 4 rotatable bond counts in 2-Chloro-6-fluoro-3-(methoxymethoxy)phenylboronic acid.