hexan-3-yl 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: hexan-3-yl 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 1-ethylbutyl 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid hexan-3-yl ester IUPAC Name: hexan-3-yl 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid 1-ethylbutyl ester Formula: C8H13F3O2 MolecularWeight: 198.18283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)OC(=O)C(F)(F)F

Isomeric SMILES

CCCC(CC)OC(=O)C(F)(F)F

InChI

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