hexyl 2-sulfooxypropanoate

Systemtic Name: hexyl 2-sulfooxypropanoate Openeye Name: hexyl 2-sulfooxypropanoate CAS Name: 2-sulfooxypropanoic acid hexyl ester IUPAC Name: hexyl 2-sulfooxypropanoate Traditional Name: 2-sulfoxypropionic acid hexyl ester Formula: C9H18O6S MolecularWeight: 254.30062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C)OS(=O)(=O)O

Isomeric SMILES

CCCCCCOC(=O)C(C)OS(=O)(=O)O

InChI

InChI=1S/C9H18O6S/c1-3-4-5-6-7-14-9(10)8(2)15-16(11,12)13/h8H,3-7H2,1-2H3,(H,11,12,13)