1-(4-bromophenyl)-4,4,4-tris(fluoranyl)-2-methyl-3-(trifluoromethyl)butane-1,3-diol

Systemtic Name: 1-(4-bromophenyl)-4,4,4-tris(fluoranyl)-2-methyl-3-(trifluoromethyl)butane-1,3-diol Openeye Name: 1-(4-bromophenyl)-4,4,4-trifluoro-2-methyl-3-(trifluoromethyl)butane-1,3-diol CAS Name: 1-(4-bromophenyl)-4,4,4-trifluoro-2-methyl-3-(trifluoromethyl)butane-1,3-diol IUPAC Name: 1-(4-bromophenyl)-4,4,4-trifluoro-2-methyl-3-(trifluoromethyl)butane-1,3-diol Traditional Name: 1-(4-bromophenyl)-4,4,4-trifluoro-2-methyl-3-(trifluoromethyl)butane-1,3-diol Formula: C12H11BrF6O2 MolecularWeight: 381.108959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11BrF6O2/c1-6(9(20)7-2-4-8(13)5-3-7)10(21,11(14,15)16)12(17,18)19/h2-6,9,20-21H,1H3