6742-54-7 Purity
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Specification
The molecular formula of 1,4-Di-tert-butylbenzene is C14H22.
The synonyms for 1,4-Di-tert-butylbenzene are p-Di-tert-butylbenzene, 1,4-ditert-butylbenzene, and Benzene, 1,4-bis(1,1-dimethylethyl)-.
The molecular weight of 1,4-Di-tert-butylbenzene is 190.32 g/mol.
The IUPAC name of 1,4-Di-tert-butylbenzene is 1,4-ditert-butylbenzene.
The InChI of 1,4-Di-tert-butylbenzene is InChI=1S/C14H22/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H3.
The InChIKey of 1,4-Di-tert-butylbenzene is OOWNNCMFKFBNOF-UHFFFAOYSA-N.
The Canonical SMILES of 1,4-Di-tert-butylbenzene is CC(C)(C)C1=CC=C(C=C1)C(C)(C)C.
The CAS number of 1,4-Di-tert-butylbenzene is 1012-72-2.
The XLogP3-AA value of 1,4-Di-tert-butylbenzene is 5.3.
The Hydrogen Bond Donor Count of 1,4-Di-tert-butylbenzene is 0.