3,4,6-tris(fluoranyl)-5-methyl-phthalic acid

Systemtic Name: 3,4,6-tris(fluoranyl)-5-methyl-phthalic acid Openeye Name: 3,4,6-trifluoro-5-methyl-phthalic acid CAS Name: 3,4,6-trifluoro-5-methylphthalic acid IUPAC Name: 3,4,6-trifluoro-5-methylphthalic acid Traditional Name: 3,4,6-trifluoro-5-methyl-phthalic acid Formula: C9H5F3O4 MolecularWeight: 234.12881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1F)F)C(=O)O)C(=O)O)F

Isomeric SMILES

CC1=C(C(=C(C(=C1F)F)C(=O)O)C(=O)O)F

InChI

InChI=1S/C9H5F3O4/c1-2-5(10)3(8(13)14)4(9(15)16)7(12)6(2)11/h1H3,(H,13,14)(H,15,16)