Organofluorine / Alfa Chemistry
2-(1,3-Benzothiazol-2-ylsulfonyl)-2-fluoro-1-phenylpropan-1-one

2-(1,3-Benzothiazol-2-ylsulfonyl)-2-fluoro-1-phenylpropan-1-one

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2-(1,3-Benzothiazol-2-ylsulfonyl)-2-fluoro-1-phenylpropan-1-one
Catalog OFC1516973231
CAS 1516973-23-1
Category Other Fluorinated Group Introducing Agents
Synonyms 1-Propanone, 2-(2-benzothiazolylsulfonyl)-2-fluoro-1-phenyl- (ACI)
2-(2-Benzothiazolylsulfonyl)-2-fluoro-1-phenyl-1-propanone (ACI)
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C16H12FNO3S2/c1-16(17,14(19)11-7-3-2-4-8-11)23(20,21)15-18-12-9-5-6-10-13(12)22-15/h2-10H,1H3
InChI Key GERQORYUKVUOCZ-UHFFFAOYSA-N
Canonical SMILES CC(F)(C(=O)c1ccccc1)S(=O)(=O)c1nc2ccccc2s1
Molecular Formula C16H12FNO3S2
Molecular Weight 349.408
Melting Point 98-100 °C
Boiling Point 519.5 °C
Density 1.42 g/cm3
Appearance White solid
Exact Mass 349.0243

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