Organofluorine / Alfa Chemistry
1-(Tert-butyl)-5-((fluoromethyl)sulfonyl)-1H-tetrazole

1-(Tert-butyl)-5-((fluoromethyl)sulfonyl)-1H-tetrazole

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1-(Tert-butyl)-5-((fluoromethyl)sulfonyl)-1H-tetrazole
Catalog OFC1236300449
CAS 1236300-44-9
Category Other Fluorinated Group Introducing Agents
Synonyms 1H-Tetrazole, 1-(1,1-dimethylethyl)-5-[(fluoromethyl)sulfonyl]- (ACI)
1-(1,1-Dimethylethyl)-5-[(fluoromethyl)sulfonyl]-1H-tetrazole (ACI)
1-tert-Butyl-1H-tetrazol-5-yl fluoromethyl sulfone
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C6H11FN4O2S/c1-6(2,3)11-5(8-9-10-11)14(12,13)4-7/h4H2,1-3H3
InChI Key CAWKMMBKHWNUCY-UHFFFAOYSA-N
Canonical SMILES CC(C)(C)n1nnnc1S(=O)(=O)CF
Molecular Formula C6H11FN4O2S
Molecular Weight 222.245
Boiling Point 357.7 °C
Density 1.46 g/cm3
Appearance Colorless oil
Exact Mass 222.0587

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