CAS
1072952-48-7 Purity
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1072952-48-7 Purity
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Specification
The molecular formula is C7H9BBrNO2.
The molecular weight is 229.87 g/mol.
It was created on March 14, 2010.
It was last modified on December 2, 2023.
The IUPAC name is (6-bromo-2,4-dimethylpyridin-3-yl)boronic acid.
The InChI is InChI=1S/C7H9BBrNO2/c1-4-3-6(9)10-5(2)7(4)8(11)12/h3,11-12H,1-2H3.
The InChIKey is GXXITYQLWOMIEM-UHFFFAOYSA-N.
The canonical SMILES is B(C1=C(N=C(C=C1C)Br)C)(O)O.
The CAS number is 1072944-23-0.
Yes, it is a canonicalized compound.