915087-24-0 Purity
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Specification
The molecular formula of 1,1,1-Trichloroacetone is C3H3Cl3O.
The molecular weight of 1,1,1-Trichloroacetone is 161.41 g/mol.
The IUPAC Name of 1,1,1-Trichloroacetone is 1,1,1-trichloropropan-2-one.
The InChIKey of 1,1,1-Trichloroacetone is SMZHKGXSEAGRTI-UHFFFAOYSA-N.
The Canonical SMILES of 1,1,1-Trichloroacetone is CC(=O)C(Cl)(Cl)Cl.
The XLogP3-AA value of 1,1,1-Trichloroacetone is 1.8.
1,1,1-Trichloroacetone has 1 hydrogen bond acceptor.
The topological polar surface area of 1,1,1-Trichloroacetone is 17.1 Ų.
1,1,1-Trichloroacetone has 7 heavy atoms.
There is 1 covalently-bonded unit in 1,1,1-Trichloroacetone.