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2,4-ditert-butylphenolate; titanium(4+)

2,4-ditert-butylphenolate; titanium(4+)

Systemtic Name:2,4-ditert-butylphenolate; titanium(4+)
Openeye Name:2,4-ditert-butylphenolate; titanium(4+)
CAS Name:2,4-ditert-butylphenolate; titanium(4+)
IUPAC Name:2,4-ditert-butylphenolate; titanium(4+)
Traditional Name:2,4-ditert-butylphenolate; titanium(4+)
Formula: C56H84O4Ti
MolecularWeight: 869.13076
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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.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.[Ti+4]


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.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.[Ti+4]


InChI

InChI=1S/4C14H22O.Ti/c4*1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6;/h4*7-9,15H,1-6H3;/q;;;;+4/p-4


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