1-octyl-3-[4-(trifluoromethyl)phenyl]bicyclo[1.1.1]pentane

Systemtic Name: 1-octyl-3-[4-(trifluoromethyl)phenyl]bicyclo[1.1.1]pentane Openeye Name: 1-octyl-3-[4-(trifluoromethyl)phenyl]bicyclo[1.1.1]pentane CAS Name: 1-octyl-3-[4-(trifluoromethyl)phenyl]bicyclo[1.1.1]pentane IUPAC Name: 1-octyl-3-[4-(trifluoromethyl)phenyl]bicyclo[1.1.1]pentane Traditional Name: 1-octyl-3-[4-(trifluoromethyl)phenyl]bicyclo[1.1.1]pentane Formula: C20H27F3 MolecularWeight: 324.42359

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC12CC(C1)(C2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCCCCC12CC(C1)(C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H27F3/c1-2-3-4-5-6-7-12-18-13-19(14-18,15-18)16-8-10-17(11-9-16)20(21,22)23/h8-11H,2-7,12-15H2,1H3