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3-tert-butyl-5-methyl-phenol; 1H-inden-1-ide; titanium; dichloride

3-tert-butyl-5-methyl-phenol; 1H-inden-1-ide; titanium; dichloride

Systemtic Name:3-tert-butyl-5-methyl-phenol; 1H-inden-1-ide; titanium; dichloride
Openeye Name:3-tert-butyl-5-methyl-phenol; 1H-inden-1-ide; titanium; dichloride
CAS Name:3-tert-butyl-5-methylphenol; 1H-inden-1-ide; titanium; dichloride
IUPAC Name:3-tert-butyl-5-methylphenol; 1H-inden-1-ide; titanium; dichloride
Traditional Name:3-tert-butyl-5-methyl-phenol; 1H-inden-1-ide; titanium; dichloride
Formula: C20H23Cl2OTi-3
MolecularWeight: 398.16902
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)O)C(C)(C)C.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Ti]


Isomeric SMILES

CC1=CC(=CC(=C1)O)C(C)(C)C.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Ti]


InChI

InChI=1S/C11H16O.C9H7.2ClH.Ti/c1-8-5-9(11(2,3)4)7-10(12)6-8;1-2-5-9-7-3-6-8(9)4-1;;;/h5-7,12H,1-4H3;1-7H;2*1H;/q;-1;;;/p-2


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