hexadecyl 5,6-bis(bromanyl)-6,6-bis(fluoranyl)hexanoate

Systemtic Name: hexadecyl 5,6-bis(bromanyl)-6,6-bis(fluoranyl)hexanoate Openeye Name: hexadecyl 5,6-dibromo-6,6-difluoro-hexanoate CAS Name: 5,6-dibromo-6,6-difluorohexanoic acid hexadecyl ester IUPAC Name: hexadecyl 5,6-dibromo-6,6-difluorohexanoate Traditional Name: 5,6-dibromo-6,6-difluoro-hexanoic acid cetyl ester Formula: C22H40Br2F2O2 MolecularWeight: 534.356606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CCCC(C(F)(F)Br)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CCCC(C(F)(F)Br)Br

InChI

InChI=1S/C22H40Br2F2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-28-21(27)18-16-17-20(23)22(24,25)26/h20H,2-19H2,1H3