4,4,5,5,5-pentakis(fluoranyl)pentyl 3-bromanylbenzoate

Systemtic Name: 4,4,5,5,5-pentakis(fluoranyl)pentyl 3-bromanylbenzoate Openeye Name: 4,4,5,5,5-pentafluoropentyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid 4,4,5,5,5-pentafluoropentyl ester IUPAC Name: 4,4,5,5,5-pentafluoropentyl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid 4,4,5,5,5-pentafluoropentyl ester Formula: C12H10BrF5O2 MolecularWeight: 361.102616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)OCCCC(C(F)(F)F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)OCCCC(C(F)(F)F)(F)F

InChI

InChI=1S/C12H10BrF5O2/c13-9-4-1-3-8(7-9)10(19)20-6-2-5-11(14,15)12(16,17)18/h1,3-4,7H,2,5-6H2