2-sulfooctanoic acid

Systemtic Name: 2-sulfooctanoic acid Openeye Name: 2-sulfooctanoic acid CAS Name: 2-sulfooctanoic acid IUPAC Name: 2-sulfooctanoic acid Traditional Name: 2-sulfocaprylic acid Formula: C8H16O5S MolecularWeight: 224.27464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H16O5S/c1-2-3-4-5-6-7(8(9)10)14(11,12)13/h7H,2-6H2,1H3,(H,9,10)(H,11,12,13)