1,3-bis(2-ethylhexoxy)propan-2-yl hydrogen sulfate

Systemtic Name: 1,3-bis(2-ethylhexoxy)propan-2-yl hydrogen sulfate Openeye Name: [2-(2-ethylhexoxy)-1-(2-ethylhexoxymethyl)ethyl] hydrogen sulfate CAS Name: sulfuric acid 1,3-bis(2-ethylhexoxy)propan-2-yl ester IUPAC Name: 1,3-bis(2-ethylhexoxy)propan-2-yl hydrogen sulfate Traditional Name: sulfuric acid [2-(2-ethylhexoxy)-1-(2-ethylhexoxymethyl)ethyl] ester Formula: C19H40O6S MolecularWeight: 396.5823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC(COCC(CC)CCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCC(CC)COCC(COCC(CC)CCCC)OS(=O)(=O)O

InChI

InChI=1S/C19H40O6S/c1-5-9-11-17(7-3)13-23-15-19(25-26(20,21)22)16-24-14-18(8-4)12-10-6-2/h17-19H,5-16H2,1-4H3,(H,20,21,22)