[2,3-di(hexan-2-yl)phenyl] phenyl sulfate

Systemtic Name: [2,3-di(hexan-2-yl)phenyl] phenyl sulfate Openeye Name: [2,3-bis(1-methylpentyl)phenyl] phenyl sulfate CAS Name: sulfuric acid [2,3-di(hexan-2-yl)phenyl] phenyl ester IUPAC Name: [2,3-di(hexan-2-yl)phenyl] phenyl sulfate Traditional Name: sulfuric acid [2,3-bis(1-methylpentyl)phenyl] phenyl ester Formula: C24H34O4S MolecularWeight: 418.58936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1=C(C(=CC=C1)OS(=O)(=O)OC2=CC=CC=C2)C(C)CCCC

Isomeric SMILES

CCCCC(C)C1=C(C(=CC=C1)OS(=O)(=O)OC2=CC=CC=C2)C(C)CCCC

InChI

InChI=1S/C24H34O4S/c1-5-7-13-19(3)22-17-12-18-23(24(22)20(4)14-8-6-2)28-29(25,26)27-21-15-10-9-11-16-21/h9-12,15-20H,5-8,13-14H2,1-4H3