39774-26-0 Purity
98%
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Specification
The molecular formula of the compound is C7H4BrFO2.
The molecular weight of the compound is 219.01 g/mol.
The IUPAC name of the compound is 5-bromo-4-fluoro-2-hydroxybenzaldehyde.
The InChI of the compound is InChI=1S/C7H4BrFO2/c8-5-1-4(3-10)7(11)2-6(5)9/h1-3,11H.
The InChIKey of the compound is QKTZGVUIYFBODQ-UHFFFAOYSA-N.
The Canonical SMILES of the compound is C1=C(C(=CC(=C1Br)F)O)C=O.
The CAS number of the compound is 399-00-8.
The XLogP3-AA value of the compound is 2.4.
The compound has 1 hydrogen bond donor count.
The compound has 3 hydrogen bond acceptor counts.