952319-71-0 Purity
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The molecular formula is C8H11F3O2.
It was created on 2005-07-19 and modified on 2023-12-30.
Some synonyms are cis-4-(Trifluoromethyl)cyclohexanecarboxylic Acid and trans-4-(Trifluoromethyl)cyclohexanecarboxylic Acid.
The molecular weight is 196.17 g/mol.
The IUPAC name is 4-(trifluoromethyl)cyclohexane-1-carboxylic acid.
The InChIKey is LMEAZIIFLVDISW-UHFFFAOYSA-N.
The Canonical SMILES is C1CC(CCC1C(=O)O)C(F)(F)F.
The CAS number is 95233-30-0.
It has 5 hydrogen bond acceptors.
The topological polar surface area is 37.3 Å2.