tert-butyl 3,5-bis(trifluoromethyl)benzenecarboperoxoate

Systemtic Name: tert-butyl 3,5-bis(trifluoromethyl)benzenecarboperoxoate Openeye Name: tert-butyl 3,5-bis(trifluoromethyl)benzenecarboperoxoate CAS Name: 3,5-bis(trifluoromethyl)benzenecarboperoxoic acid tert-butyl ester IUPAC Name: tert-butyl 3,5-bis(trifluoromethyl)benzenecarboperoxoate Traditional Name: 3,5-bis(trifluoromethyl)benzenecarboperoxoic acid tert-butyl ester Formula: C13H12F6O3 MolecularWeight: 330.222999

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12F6O3/c1-11(2,3)22-21-10(20)7-4-8(12(14,15)16)6-9(5-7)13(17,18)19/h4-6H,1-3H3