2-[3,5-bis(trifluoromethyl)phenyl]butanoic acid

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]butanoic acid Openeye Name: 2-[3,5-bis(trifluoromethyl)phenyl]butanoic acid CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]butanoic acid IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]butanoic acid Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]butyric acid Formula: C12H10F6O2 MolecularWeight: 300.197019

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)O

Isomeric SMILES

CCC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H10F6O2/c1-2-9(10(19)20)6-3-7(11(13,14)15)5-8(4-6)12(16,17)18/h3-5,9H,2H2,1H3,(H,19,20)