2-[3-(trifluoromethyl)phenyl]-1,3,6,2-dioxazaborocane

Systemtic Name: 2-[3-(trifluoromethyl)phenyl]-1,3,6,2-dioxazaborocane Openeye Name: 2-[3-(trifluoromethyl)phenyl]-1,3,6,2-dioxazaborocane CAS Name: 2-[3-(trifluoromethyl)phenyl]-1,3,6,2-dioxazaborocane IUPAC Name: 2-[3-(trifluoromethyl)phenyl]-1,3,6,2-dioxazaborocane Traditional Name: 2-[3-(trifluoromethyl)phenyl]-1,3,6,2-dioxazaborocane Formula: C11H13BF3NO2 MolecularWeight: 259.03263

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCCNCCO1)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

B1(OCCNCCO1)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C11H13BF3NO2/c13-11(14,15)9-2-1-3-10(8-9)12-17-6-4-16-5-7-18-12/h1-3,8,16H,4-7H2