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4-(3-tert-butylcyclopenta-1,3-dien-1-yl)-2,3-dimethyl-phenol; methane; titanium(2+); dichloride

4-(3-tert-butylcyclopenta-1,3-dien-1-yl)-2,3-dimethyl-phenol; methane; titanium(2+); dichloride

Systemtic Name:4-(3-tert-butylcyclopenta-1,3-dien-1-yl)-2,3-dimethyl-phenol; methane; titanium(2+); dichloride
Openeye Name:4-(3-tert-butylcyclopenta-1,3-dien-1-yl)-2,3-dimethyl-phenol; methane; titanium(2+); dichloride
CAS Name:4-(3-tert-butyl-1-cyclopenta-1,3-dienyl)-2,3-dimethylphenol; methane; titanium(2+); dichloride
IUPAC Name:4-(3-tert-butylcyclopenta-1,3-dien-1-yl)-2,3-dimethylphenol; methane; titanium(2+); dichloride
Traditional Name:4-(3-tert-butylcyclopenta-1,3-dien-1-yl)-2,3-dimethyl-phenol; methane; titanium(2+); dichloride
Formula: C18H26Cl2OTi
MolecularWeight: 377.17144
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Descriptors Computed from Structure

Canonical SMILES:

C.CC1=C(C=CC(=C1C)O)C2=CC(=CC2)C(C)(C)C.[Cl-].[Cl-].[Ti+2]


Isomeric SMILES

C.CC1=C(C=CC(=C1C)O)C2=CC(=CC2)C(C)(C)C.[Cl-].[Cl-].[Ti+2]


InChI

InChI=1S/C17H22O.CH4.2ClH.Ti/c1-11-12(2)16(18)9-8-15(11)13-6-7-14(10-13)17(3,4)5;;;;/h7-10,18H,6H2,1-5H3;1H4;2*1H;/q;;;;+2/p-2


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