hexan-2-yl 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: hexan-2-yl 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 1-methylpentyl 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid hexan-2-yl ester IUPAC Name: hexan-2-yl 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid 1-methylpentyl ester Formula: C8H13F3O2 MolecularWeight: 198.18283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)OC(=O)C(F)(F)F

Isomeric SMILES

CCCCC(C)OC(=O)C(F)(F)F

InChI

InChI=1S/C8H13F3O2/c1-3-4-5-6(2)13-7(12)8(9,10)11/h6H,3-5H2,1-2H3