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Tralopyril Structure

Tralopyril

Chemical Properties

Boiling point 450.6±45.0 °C(Predicted)
Density  1.78±0.1 g/cm3(Predicted)
pka 10.24±0.50(Predicted)
Henry's Law Constant 4.5×103 mol/(m3Pa) at 25℃, Ebert et al. (2023)
InChI InChI=1S/C12H5BrClF3N2/c13-9-8(5-18)10(19-11(9)12(15,16)17)6-1-3-7(14)4-2-6/h1-4,19H
InChIKey XNFIRYXKTXAHAC-UHFFFAOYSA-N
SMILES N1C(C(F)(F)F)=C(Br)C(C#N)=C1C1=CC=C(Cl)C=C1
EPA Substance Registry System 4-Bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)pyrrole-3-carbonitrile (122454-29-9)

Safety Information

Hazard Codes  N
Risk Statements  50/53
Safety Statements  60-61

Usage And Synthesis

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