3,3,3-tris(fluoranyl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3,3,3-tris(fluoranyl)propyl 4-methylbenzenesulfonate Openeye Name: 3,3,3-trifluoropropyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3,3,3-trifluoropropyl ester IUPAC Name: 3,3,3-trifluoropropyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3,3,3-trifluoropropyl ester Formula: C10H11F3O3S MolecularWeight: 268.25275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(F)(F)F

InChI

InChI=1S/C10H11F3O3S/c1-8-2-4-9(5-3-8)17(14,15)16-7-6-10(11,12)13/h2-5H,6-7H2,1H3