3-[2,5-bis(fluoranyl)phenyl]propanoic acid

Systemtic Name: 3-[2,5-bis(fluoranyl)phenyl]propanoic acid Openeye Name: 3-(2,5-difluorophenyl)propanoic acid CAS Name: 3-(2,5-difluorophenyl)propanoic acid IUPAC Name: 3-(2,5-difluorophenyl)propanoic acid Traditional Name: 3-(2,5-difluorophenyl)propionic acid Formula: C9H8F2O2 MolecularWeight: 186.155426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)CCC(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1F)CCC(=O)O)F

InChI

InChI=1S/C9H8F2O2/c10-7-2-3-8(11)6(5-7)1-4-9(12)13/h2-3,5H,1,4H2,(H,12,13)