108749-15-1 Purity
98%
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Specification
The molecular formula of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is C10H14BBrO3.
The molecular weight of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is 272.93 g/mol.
3-Bromo-2-isopropoxy-5-methylphenylboronic acid was created on September 13, 2005.
The last modification date of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is December 2, 2023.
The IUPAC name of the compound is (3-bromo-5-methyl-2-propan-2-yloxyphenyl)boronic acid.
The InChI of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is InChI=1S/C10H14BBrO3/c1-6(2)15-10-8(11(13)14)4-7(3)5-9(10)12/h4-6,13-14H,1-3H3.
The InChIKey of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is VTDMHYFQQWORBC-UHFFFAOYSA-N.
The canonical SMILES representation of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is B(C1=CC(=CC(=C1OC(C)C)Br)C)(O)O.
The CAS number of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is 870718-01-7.
The hydrogen bond donor count of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid is 2.