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dodecyl 4-hexadecyl-2,6-dimethyl-benzenesulfonate

dodecyl 4-hexadecyl-2,6-dimethyl-benzenesulfonate

Systemtic Name:dodecyl 4-hexadecyl-2,6-dimethyl-benzenesulfonate
Openeye Name:dodecyl 4-hexadecyl-2,6-dimethyl-benzenesulfonate
CAS Name:4-hexadecyl-2,6-dimethylbenzenesulfonic acid dodecyl ester
IUPAC Name:dodecyl 4-hexadecyl-2,6-dimethylbenzenesulfonate
Traditional Name:4-cetyl-2,6-dimethyl-benzenesulfonic acid lauryl ester
Formula: C36H66O3S
MolecularWeight: 578.97244
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)C)S(=O)(=O)OCCCCCCCCCCCC)C


Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)C)S(=O)(=O)OCCCCCCCCCCCC)C


InChI

InChI=1S/C36H66O3S/c1-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-35-31-33(3)36(34(4)32-35)40(37,38)39-30-28-26-24-22-16-14-12-10-8-6-2/h31-32H,5-30H2,1-4H3


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