dihexyl hydrogen phosphite; oxidanylidenetitanium; propane; dihydrate

Systemtic Name: dihexyl hydrogen phosphite; oxidanylidenetitanium; propane; dihydrate Openeye Name: dihexyl hydrogen phosphite; oxotitanium; propane; dihydrate CAS Name: dihexyl hydrogen phosphite; oxotitanium; propane; dihydrate IUPAC Name: dihexyl hydrogen phosphite; oxotitanium; propane; dihydrate Traditional Name: dihexyl hydrogen phosphite; ketotitanium; propane; dihydrate Formula: C36H86O9P2Ti-4 MolecularWeight: 772.877162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOP(O)OCCCCCC.CCCCCCOP(O)OCCCCCC.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.O.O.O=[Ti]

Isomeric SMILES

CCCCCCOP(O)OCCCCCC.CCCCCCOP(O)OCCCCCC.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.O.O.O=[Ti]

InChI

InChI=1S/2C12H27O3P.4C3H7.2H2O.O.Ti/c2*1-3-5-7-9-11-14-16(13)15-12-10-8-6-4-2;4*1-3-2;;;;/h2*13H,3-12H2,1-2H3;4*3H,1-2H3;2*1H2;;/q;;4*-1;;;;