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The molecular formula is C7H5F9O2.
The molecular weight is 292.10 g/mol.
It was created on 2010-03-14.
The IUPAC name is [1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl] propanoate.
The Canonical SMILES is CCC(=O)OC(C(F)(F)F)(C(F)(F)F)C(F)(F)F.
The InChIKey is QMZWPYNRTTVYRG-UHFFFAOYSA-N.
It has 11 hydrogen bond acceptors.
The topological polar surface area is 26.3 Ų.
Yes, the compound is canonicalized.
It has 3 rotatable bond counts.
914637-20-2
914637-23-3
914637-28-8
914637-43-7
914637-45-9
914637-47-1
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