2,2-bis(hydroxymethyl)butyl 3-dodecylsulfanyl-2-methyl-propanoate

Systemtic Name: 2,2-bis(hydroxymethyl)butyl 3-dodecylsulfanyl-2-methyl-propanoate Openeye Name: 2,2-bis(hydroxymethyl)butyl 3-dodecylsulfanyl-2-methyl-propanoate CAS Name: 3-(dodecylthio)-2-methylpropanoic acid 2,2-bis(hydroxymethyl)butyl ester IUPAC Name: 2,2-bis(hydroxymethyl)butyl 3-dodecylsulfanyl-2-methylpropanoate Traditional Name: 3-(laurylthio)-2-methyl-propionic acid 2,2-dimethylolbutyl ester Formula: C22H44O4S MolecularWeight: 404.64736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(C)C(=O)OCC(CC)(CO)CO

Isomeric SMILES

CCCCCCCCCCCCSCC(C)C(=O)OCC(CC)(CO)CO

InChI

InChI=1S/C22H44O4S/c1-4-6-7-8-9-10-11-12-13-14-15-27-16-20(3)21(25)26-19-22(5-2,17-23)18-24/h20,23-24H,4-19H2,1-3H3