octanoic acid; propan-2-ol; titanium

Systemtic Name: octanoic acid; propan-2-ol; titanium Openeye Name: octanoic acid; propan-2-ol; titanium CAS Name: octanoic acid; 2-propanol; titanium IUPAC Name: octanoic acid; propan-2-ol; titanium Traditional Name: caprylic acid; propan-2-ol; titanium Formula: C27H56O7Ti MolecularWeight: 540.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCCC(=O)O.CC(C)O.[Ti]

Isomeric SMILES

CCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCCC(=O)O.CC(C)O.[Ti]

InChI

InChI=1S/3C8H16O2.C3H8O.Ti/c3*1-2-3-4-5-6-7-8(9)10;1-3(2)4;/h3*2-7H2,1H3,(H,9,10);3-4H,1-2H3;