1213037-93-4 Purity
96%
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The molecular formula is C17H13BrN2O2.
The compound was created on 2011-09-06 and modified on 2023-12-02.
The IUPAC name is 5-bromo-3-(4-methoxyphenyl)-1-phenylpyrazole-4-carbaldehyde.
The InChI is InChI=1S/C17H13BrN2O2/c1-22-14-9-7-12(8-10-14)16-15(11-21)17(18)20(19-16)13-5-3-2-4-6-13/h2-11H,1H3.
The molecular weight is 357.2 g/mol.
The compound has 3 Hydrogen Bond Acceptor Counts.
The XLogP3-AA value is 4.
The exact mass and monoisotopic mass is 356.01604 g/mol.
The topological polar surface area is 44.1Ų.
Yes, the compound is canonicalized.