(Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid structure

(Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid

(Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid

Also Known As: EINECS 270-841-8|9-Octadecenoic acid, 9-sulfo-, 1-(branched and linear pentyl) esters|(Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid

CAS: 68478-85-3
Molecular Formula C23H44O5S
Molecular Weight 432.29095 g/mol
LogP 6.8287
Topological Polar Surface Area 80.67 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 19
Exact Mass 432.29095
Monoisotopic Mass 432.29095
Heavy Atoms 29
Complexity 539.47144

Chemical Identifiers

CAS Number 68478-85-3
SMILES CCCCCCCC/C=C(/CCCCCCCC(=O)OCC(C)CC)\S(=O)(=O)O

Product Overview

(Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid (CAS 68478-85-3), with molecular formula C23H44O5S and molecular weight 432.29095 g/mol. IUPAC: (Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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(Z)-1-(2-methylbutoxy)-1-oxooctadec-9-ene-9-sulfonic acid is a custom synthesis product. We offer services from milligram to kilogram scale.

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