Organofluorine / Alfa Chemistry
Dodecanoic acid, 2-fluoro-2-(phenylsulfinyl)-, ethyl ester (9CI, ACI)

Dodecanoic acid, 2-fluoro-2-(phenylsulfinyl)-, ethyl ester (9CI, ACI)

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Dodecanoic acid, 2-fluoro-2-(phenylsulfinyl)-, ethyl ester (9CI, ACI)
Catalog OFC156002050
CAS 156002-05-0
Category Other Fluorinated Group Introducing Agents
Synonyms Ethyl 2-fluoro-2-(phenylsulfinyl)dodecanoate (ACI)
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C20H31FO3S/c1-3-5-6-7-8-9-10-14-17-20(21,19(22)24-4-2)25(23)18-15-12-11-13-16-18/h11-13,15-16H,3-10,14,17H2,1-2H3
InChI Key TYJYONUSOITGNY-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCCCC(F)(C(=O)OCC)S(=O)c1ccccc1
Molecular Formula C20H31FO3S
Molecular Weight 370.53
Boiling Point 478.8 °C
Density 1.09 g/cm3
Appearance Colorless oil
Exact Mass 370.1978

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