4-Bromobenzoylacetonitrile

4-Bromobenzoylacetonitrile Basic information
Product Name:4-Bromobenzoylacetonitrile
Synonyms:3-(4-Bromo-phenyl)-3-oxo-propionitrile;JR-8665, 3-(4-Bromophenyl)-3-oxopropanenitrile, 97%;BUTTPARK 35\09-90;4-BROMOBENZOYLACETONITRILE;3-(4'-BROMOPHENYL)-3-OXOPROPANENITRILE;3-(4-BROMOPHENYL)-3-OXOPROPANENITRILE;p-BroMobenzoylacetonitrile;4-broMobenzoylacetonitirle
CAS:4592-94-3
MF:C9H6BrNO
MW:224.05
EINECS:
Product Categories:
Mol File:4592-94-3.mol
4-Bromobenzoylacetonitrile Structure
4-Bromobenzoylacetonitrile Chemical Properties
Melting point 161-163
Boiling point 370.0±27.0 °C(Predicted)
density 1.523±0.06 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
pka7.37±0.10(Predicted)
CAS DataBase Reference4592-94-3(CAS DataBase Reference)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26
WGK Germany 3
HazardClass IRRITANT
HS Code 2926907090
MSDS Information
4-Bromobenzoylacetonitrile Usage And Synthesis
Uses4-Bromobenzoylacetonitrile is a useful research chemical used in the preparation of mechanistic studies, and fluorescence of naphtho[1,8-bc]pyrans via rhodium-catalyzed cascade oxidative annulation of benzoylacetonitriles with internal alkynes.
Purification MethodsThe nitrile is purified by dissolving in slightly alkaline H2O (charcoal), filtering and acidifying with HCl to give colourless needles (m 162-163o). It recrystallises from EtOH. With Me2SO4/KOH at 130o it gives 4-bromo-methoxycinnamylnitrile m 58.5-59.5o (from high boiling pet ether) [Fuson & Wolf J Am Chem Soc 61 1940 1939, Grathaus & Dains J Am Chem Soc 58 1334 1936]. [Beilstein 10 III 2998.]
4-Bromobenzoylacetonitrile Preparation Products And Raw materials
Preparation Products2-[(DIMETHYLAMINO)METHYLENE]-3-(4-BROMOPHENYL)-3-OXO-PROPANENITRILE
4-Bromobenzoylacetonitrile 2-[(DIMETHYLAMINO)METHYLENE]-3-(4-BROMOPHENYL)-3-OXO-PROPANENITRILE 4'-Bromopropiophenone 2-Bromofluorobenzene AURORA KA-7439 Bromobenzyl cyanide Bromoxynil octanoate Bromoxynil 3-Bromoanisole 3-(4-BROMO-1-NAPHTHYL)-3-OXOPROPANENITRILE (3-Methoxyphenyl)acetonitrile AURORA KA-7442 cyanoacetaldehyde Benzoylacetonitrile AURORA 13454 3-(4-Bromo-2-fluorophenyl)-3-oxopropanenitrile AURORA KA-7445 3-(4-bromo-3-nitrophenyl)-3-oxopropanenitrile

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