bis(4-dodecylphenyl) hydrogen phosphite; bis(oxidanyl)-oxidanylidene-titanium; octane; octane

Systemtic Name: bis(4-dodecylphenyl) hydrogen phosphite; bis(oxidanyl)-oxidanylidene-titanium; octane; octane Openeye Name: bis(4-dodecylphenyl) hydrogen phosphite; dihydroxy(oxo)titanium; octane; octane CAS Name: bis(4-dodecylphenyl) hydrogen phosphite; dihydroxy(oxo)titanium; octane; octane IUPAC Name: bis(4-dodecylphenyl) hydrogen phosphite; dihydroxy(oxo)titanium; octane; octane Traditional Name: bis(4-laurylphenyl) hydrogen phosphite; dihydroxy(keto)titanium; n-octane; octane Formula: C104H191O9P2Ti- MolecularWeight: 1695.438462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC.CCCCCCCC.CCCCCCCC.CCCCCCC[CH2-].CCCCCCCCCCCCC1=CC=C(C=C1)OP(O)OC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)OP(O)OC2=CC=C(C=C2)CCCCCCCCCCCC.O[Ti](=O)O

Isomeric SMILES

CCCCCCCC.CCCCCCCC.CCCCCCCC.CCCCCCC[CH2-].CCCCCCCCCCCCC1=CC=C(C=C1)OP(O)OC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)OP(O)OC2=CC=C(C=C2)CCCCCCCCCCCC.O[Ti](=O)O

InChI

InChI=1S/2C36H59O3P.3C8H18.C8H17.2H2O.O.Ti/c2*1-3-5-7-9-11-13-15-17-19-21-23-33-25-29-35(30-26-33)38-40(37)39-36-31-27-34(28-32-36)24-22-20-18-16-14-12-10-8-6-4-2;4*1-3-5-7-8-6-4-2;;;;/h2*25-32,37H,3-24H2,1-2H3;3*3-8H2,1-2H3;1,3-8H2,2H3;2*1H2;;/q;;;;;-1;;;;+2/p-2