pentane-2,4-dione; 2,2,2-tris(chloranyl)ethanoic acid

Systemtic Name: pentane-2,4-dione; 2,2,2-tris(chloranyl)ethanoic acid Openeye Name: pentane-2,4-dione; 2,2,2-trichloroacetic acid CAS Name: pentane-2,4-dione; 2,2,2-trichloroacetic acid IUPAC Name: pentane-2,4-dione; 2,2,2-trichloroacetic acid Traditional Name: pentane-2,4-dione; 2,2,2-trichloroacetic acid Formula: C7H9Cl3O4 MolecularWeight: 263.50296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C.C(=O)(C(Cl)(Cl)Cl)O

Isomeric SMILES

CC(=O)CC(=O)C.C(=O)(C(Cl)(Cl)Cl)O

InChI

InChI=1S/C5H8O2.C2HCl3O2/c1-4(6)3-5(2)7;3-2(4,5)1(6)7/h3H2,1-2H3;(H,6,7)