2,4-ditert-butylphenol; furan-2-ylmethylidenetitanium; dichloride

Systemtic Name: 2,4-ditert-butylphenol; furan-2-ylmethylidenetitanium; dichloride Openeye Name: 2,4-ditert-butylphenol; 2-furylmethylenetitanium; dichloride CAS Name: 2,4-ditert-butylphenol; 2-furanylmethylidenetitanium; dichloride IUPAC Name: 2,4-ditert-butylphenol; furan-2-ylmethylidenetitanium; dichloride Traditional Name: 2,4-ditert-butylphenol; 2-furfurylidenetitanium; dichloride Formula: C33H48Cl2O3Ti-2 MolecularWeight: 611.50542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C.CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C.C1=COC(=C1)C=[Ti].[Cl-].[Cl-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C.CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C.C1=COC(=C1)C=[Ti].[Cl-].[Cl-]

InChI

InChI=1S/2C14H22O.C5H4O.2ClH.Ti/c2*1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6;1-5-3-2-4-6-5;;;/h2*7-9,15H,1-6H3;1-4H;2*1H;/p-2