1-octyl-2-(2-octylphenoxy)benzene phosphate

Systemtic Name: 1-octyl-2-(2-octylphenoxy)benzene phosphate Openeye Name: 1-octyl-2-(2-octylphenoxy)benzene phosphate CAS Name: 1-octyl-2-(2-octylphenoxy)benzene phosphate IUPAC Name: 1-octyl-2-(2-octylphenoxy)benzene phosphate Traditional Name: 1-octyl-2-(2-octylphenoxy)benzene phosphate Formula: C28H42O5P-3 MolecularWeight: 489.603841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCC.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1OC2=CC=CC=C2CCCCCCCC.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C28H42O.H3O4P/c1-3-5-7-9-11-13-19-25-21-15-17-23-27(25)29-28-24-18-16-22-26(28)20-14-12-10-8-6-4-2;1-5(2,3)4/h15-18,21-24H,3-14,19-20H2,1-2H3;(H3,1,2,3,4)/p-3