3,6-diphenyl-1,2,4,5-tetraoxane; tris(2-methylphenyl) phosphate

Systemtic Name: 3,6-diphenyl-1,2,4,5-tetraoxane; tris(2-methylphenyl) phosphate Openeye Name: 3,6-diphenyl-1,2,4,5-tetraoxane; tris-o-tolyl phosphate CAS Name: 3,6-diphenyl-1,2,4,5-tetraoxane; phosphoric acid tris(2-methylphenyl) ester IUPAC Name: 3,6-diphenyl-1,2,4,5-tetraoxane; tris(2-methylphenyl) phosphate Traditional Name: 3,6-diphenyl-1,2,4,5-tetraoxane; phosphoric acid tris-o-tolyl ester Formula: C35H33O8P MolecularWeight: 612.605481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OP(=O)(OC2=CC=CC=C2C)OC3=CC=CC=C3C.C1=CC=C(C=C1)C2OOC(OO2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1OP(=O)(OC2=CC=CC=C2C)OC3=CC=CC=C3C.C1=CC=C(C=C1)C2OOC(OO2)C3=CC=CC=C3

InChI

InChI=1S/C21H21O4P.C14H12O4/c1-16-10-4-7-13-19(16)23-26(22,24-20-14-8-5-11-17(20)2)25-21-15-9-6-12-18(21)3;1-3-7-11(8-4-1)13-15-17-14(18-16-13)12-9-5-2-6-10-12/h4-15H,1-3H3;1-10,13-14H