dioctyl hydrogen phosphite; octane; oxidanylidenetitanium; propane; dihydrate

Systemtic Name: dioctyl hydrogen phosphite; octane; oxidanylidenetitanium; propane; dihydrate Openeye Name: dioctyl hydrogen phosphite; octane; oxotitanium; propane; dihydrate CAS Name: dioctyl hydrogen phosphite; octane; oxotitanium; propane; dihydrate IUPAC Name: dioctyl hydrogen phosphite; octane; oxotitanium; propane; dihydrate Traditional Name: dioctyl hydrogen phosphite; ketotitanium; n-propane; octane; dihydrate Formula: C76H174O9P2Ti-4 MolecularWeight: 1342.003882

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CCC.CCC.CCC.CCCCCCC[CH2-].CCCCCCC[CH2-].CCCCCCC[CH2-].CCCCCCC[CH2-].CCCCCCCCOP(O)OCCCCCCCC.CCCCCCCCOP(O)OCCCCCCCC.O.O.O=[Ti]

Isomeric SMILES

CCC.CCC.CCC.CCC.CCCCCCC[CH2-].CCCCCCC[CH2-].CCCCCCC[CH2-].CCCCCCC[CH2-].CCCCCCCCOP(O)OCCCCCCCC.CCCCCCCCOP(O)OCCCCCCCC.O.O.O=[Ti]

InChI

InChI=1S/2C16H35O3P.4C8H17.4C3H8.2H2O.O.Ti/c2*1-3-5-7-9-11-13-15-18-20(17)19-16-14-12-10-8-6-4-2;4*1-3-5-7-8-6-4-2;4*1-3-2;;;;/h2*17H,3-16H2,1-2H3;4*1,3-8H2,2H3;4*3H2,1-2H3;2*1H2;;/q;;4*-1;;;;;;;;