Benzene, [[(1,1-dimethylethyl)thio]methyl]- structure

Benzene, [[(1,1-dimethylethyl)thio]methyl]-

tert-butylsulfanylmethylbenzene

Also Known As: benzene|Benzyl tert-butyl sulfide|tert-butylsulfanylmethylbenzene|benzyl t-butyl sulfide|Benzyl(tert-butyl)sulfane|[(tert-Butylsulfanyl)methyl]benzene|tert-Butyl benzyl sulfide|tert-Butylthiomethylbenzene|Benzyl tert-butyl thioether|(tert-Butylthiomethyl)benzene|Benzene, [[(1,1-dimethylethyl)thio]methyl]-|1,1-dimethylethylthiomethylbenzene|[(tert-Butylthio)methyl]benzene|2-(Benzylthio)-2-methylpropane|[(tert-Butylsulfanyl)methyl]benzene #|[[(1,1-Dimethylethyl)thio]methyl]benzene

CAS: 7417-73-4
Molecular Formula C11H16S
Molecular Weight 180.09727 g/mol
LogP 3.4
Topological Polar Surface Area 25.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
Rotatable Bonds 3
Exact Mass 180.09727
Monoisotopic Mass 180.09727
Heavy Atoms 12
Complexity 117.0

Chemical Identifiers

CAS Number 7417-73-4
SMILES CC(C)(C)SCC1=CC=CC=C1
InChIKey HDIIUAPZHHLGMR-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (1 patents) Catalysts (9 patents) Electronic Chemicals (1 patents) Heterocyclic Building Blocks (7 patents) Organic Building Blocks (3 patents)

Product Overview

Benzene, [[(1,1-dimethylethyl)thio]methyl]- (CAS 7417-73-4), with molecular formula C11H16S and molecular weight 180.09727 g/mol. IUPAC: tert-butylsulfanylmethylbenzene.

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