3,5-ditert-butylphenolate chloride

Systemtic Name: 3,5-ditert-butylphenolate chloride Openeye Name: 3,5-ditert-butylphenolate chloride CAS Name: 3,5-ditert-butylphenolate chloride IUPAC Name: 3,5-ditert-butylphenolate chloride Traditional Name: 3,5-ditert-butylphenolate chloride Formula: C14H21ClO-2 MolecularWeight: 240.76894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O.ClH/c1-13(2,3)10-7-11(14(4,5)6)9-12(15)8-10;/h7-9,15H,1-6H3;1H/p-2