disodium 2-ethylhexan-1-ol sulfate

Systemtic Name: disodium 2-ethylhexan-1-ol sulfate Openeye Name: disodium 2-ethylhexan-1-ol sulfate CAS Name: disodium 2-ethyl-1-hexanol sulfate IUPAC Name: disodium 2-ethylhexan-1-ol sulfate Traditional Name: disodium 2-ethylhexan-1-ol sulfate Formula: C8H18Na2O5S MolecularWeight: 272.27006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CO.[O-]S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCC(CC)CO.[O-]S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C8H18O.2Na.H2O4S/c1-3-5-6-8(4-2)7-9;;;1-5(2,3)4/h8-9H,3-7H2,1-2H3;;;(H2,1,2,3,4)/q;2*+1;/p-2