tris[4-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate

Systemtic Name: tris[4-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate Openeye Name: tris[4-(1,1,3,3-tetramethylbutyl)phenyl] phosphate CAS Name: phosphoric acid tris[4-(2,4,4-trimethylpentan-2-yl)phenyl] ester IUPAC Name: tris[4-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate Traditional Name: phosphoric acid tris[4-(1,1,3,3-tetramethylbutyl)phenyl] ester Formula: C42H63O4P MolecularWeight: 662.920981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)OC3=CC=C(C=C3)C(C)(C)CC(C)(C)C

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)OC3=CC=C(C=C3)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C42H63O4P/c1-37(2,3)28-40(10,11)31-16-22-34(23-17-31)44-47(43,45-35-24-18-32(19-25-35)41(12,13)29-38(4,5)6)46-36-26-20-33(21-27-36)42(14,15)30-39(7,8)9/h16-27H,28-30H2,1-15H3