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28122-13-6

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28122-13-6 Structure

28122-13-6 Structure
IdentificationBack Directory
[Name]

4-FLUOROPHENYLSULFONYLETHANOL
[CAS]

28122-13-6
[Synonyms]

4-FLUOROPHENYLSULFONYLETHANOL
2-((4-Fluorophenyl)sulfonyl)ethanol
Ethanol, 2-[(4-fluorophenyl)sulfonyl]-
[Molecular Formula]

C8H9FO3S
[MDL Number]

MFCD03789137
[MOL File]

28122-13-6.mol
[Molecular Weight]

204.22
Chemical PropertiesBack Directory
[Melting point ]

59-62°C
[Boiling point ]

384.1±42.0 °C(Predicted)
[density ]

1.366±0.06 g/cm3(Predicted)
[pka]

13.54±0.10(Predicted)
[InChI]

InChI=1S/C8H9FO3S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4,10H,5-6H2
[InChIKey]

BUQOMEFZYUQRIV-UHFFFAOYSA-N
[SMILES]

C(O)CS(C1=CC=C(F)C=C1)(=O)=O
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H311-H331
[Precautionary statements ]

P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
Spectrum DetailBack Directory
[Spectrum Detail]

4-FLUOROPHENYLSULFONYLETHANOL(28122-13-6)1HNMR
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