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Specification
The molecular formula of 3-Fluoro-4-(trifluoromethyl)benzaldehyde is C8H4F4O.
The compound was first created on July 19, 2005.
The molecular weight is 192.11 g/mol.
The IUPAC name of 3-Fluoro-4-(trifluoromethyl)benzaldehyde is 3-fluoro-4-(trifluoromethyl)benzaldehyde.
The canonical SMILES is C1=CC(=C(C=C1C=O)F)C(F)(F)F.
The InChIKey is ZVIQXFUBNNGOJY-UHFFFAOYSA-N.
The compound has 5 hydrogen bond acceptor counts.
The topological polar surface area is 17.1 2.
No, the compound does not have any defined atom stereocenter count.
Yes, the compound is canonicalized.