Organofluorine / Alfa Chemistry
1-Butanone, 2-(2-benzothiazolylsulfonyl)-2-fluoro-1-phenyl-

1-Butanone, 2-(2-benzothiazolylsulfonyl)-2-fluoro-1-phenyl-

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1-Butanone, 2-(2-benzothiazolylsulfonyl)-2-fluoro-1-phenyl-
Catalog OFC1516973253
CAS 1516973-25-3
Category Other Fluorinated Group Introducing Agents
Synonyms 2-(2-Benzothiazolylsulfonyl)-2-fluoro-1-phenyl-1-butanone (ACI)
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C17H14FNO3S2/c1-2-17(18,15(20)12-8-4-3-5-9-12)24(21,22)16-19-13-10-6-7-11-14(13)23-16/h3-11H,2H2,1H3
InChI Key YBYFKQFXPORKTR-UHFFFAOYSA-N
Canonical SMILES CCC(F)(C(=O)c1ccccc1)S(=O)(=O)c1nc2ccccc2s1
Molecular Formula C17H14FNO3S2
Molecular Weight 363.435
Melting Point 105-107 °C
Boiling Point 527.4 °C
Density 1.384 g/cm3
Appearance White solid
Exact Mass 363.0399

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