4-(2-bromophenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanal

Systemtic Name: 4-(2-bromophenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanal Openeye Name: 4-(2-bromophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal CAS Name: 4-(2-bromophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal IUPAC Name: 4-(2-bromophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal Traditional Name: 4-(2-bromophenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)valeraldehyde Formula: C13H14BrF3O2 MolecularWeight: 339.14827

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C=O)(C(F)(F)F)O)C1=CC=CC=C1Br

Isomeric SMILES

CC(C)(CC(C=O)(C(F)(F)F)O)C1=CC=CC=C1Br

InChI

InChI=1S/C13H14BrF3O2/c1-11(2,9-5-3-4-6-10(9)14)7-12(19,8-18)13(15,16)17/h3-6,8,19H,7H2,1-2H3