77609-09-7

Basic information

• Product Name: [1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]malononitrile
• Synonyms: [1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]malononitrile;[1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]propanedinitrile
• CAS NO: 77609-09-7
• Molecular Formula: C₁₈H₁₃ClN₂O
• Molecular Weight: 308.76162
• Mol File: 77609-09-7.mol
• Article Data: 20

Chemical Properties

• Appearance: /
• CAS DataBase Reference: [1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]malononitrile(CAS DataBase Reference)
• NIST Chemistry Reference: [1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]malononitrile(77609-09-7)
• EPA Substance Registry System: [1-(4-chlorophenyl)-3-oxo-3-phenylpropyl]malononitrile(77609-09-7)

Safety Data

• Hazardous Substances Data: 77609-09-7(Hazardous Substances Data)

Upstream product

• 70-11-1 α-bromoacetophenone 
• 104-88-1 4-chlorobenzaldehyde 
• 24721-26-4 4-chlorochalcone 
• 109-77-3 malononitrile 
• 956-04-7 3-(4-chlorophenyl)-1-phenylprop-2-en-1-one 

Downstream Products

• 1383253-45-9 methyl 2-(4-chlorophenyl)-4-oxo-4-phenylbutanoate 
• 78564-25-7 C₃₆H₂₀Cl₂N₄S₂ 
• 143882-86-4 3-Amino-4-(4-chloro-phenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester 
• 143882-81-9 [4-(4-Chloro-phenyl)-3-cyano-6-phenyl-pyridin-2-ylsulfanyl]-acetic acid ethyl ester 
• 94360-51-7 4-(4-Chloro-phenyl)-2-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-6-phenyl-nicotinonitrile 
• 94360-44-8 4'-(4-Chloro-phenyl)-6'-phenyl-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-3'-carbonitrile 
• 24959-20-4 trans-2-benzoyl-3-(4'-chlorophenyl)-1,1-dicyanocyclopropane 
• 94360-13-1 2-Bromo-2-[1-(4-chloro-phenyl)-3-oxo-3-phenyl-propyl]-malononitrile 
• 94360-22-2 2-Chloro-2-[1-(4-chloro-phenyl)-3-oxo-3-phenyl-propyl]-malononitrile 
• 94360-27-7 2-Bromo-4-(4-chloro-phenyl)-6-phenyl-nicotinonitrile 
• 78564-16-6 4-(4-Chlor-phenyl)-6-phenyl-2-thioxo-1,2-dihydro-pyridin-3-carbonitril 

Relevant articles and documents

Cu(II)-Promoted Cascade Synthesis of Fused Imidazo-Pyridine-Carbonitriles

A Cu(II)-promoted synthesis of an aza-fused N-heterocycle having a benz-imidazopyridine scaffold is developed via an addition-cyclization reaction followed by an Ullmann-type C-N coupling between o-iodoanilines and γ-ketodinitriles. This protocol features a broad substrate scope, giving products in 32-84% yields. The compounds show excellent photoluminescence properties having two absorption maxima in the region between 270-280 and 338-350 nm and emission maxima in the range of 502-533 nm. The HOMO-LUMO energy gap of 3.49-3.57 eV was determined using Gaussian 09 at the B3LYP/6-31G (d, p) basis set level. We also demonstrated a few postsynthetic modifications.

One-Pot Quinine-Catalyzed Synthesis of α-Chiral γ-Keto Esters: Enantioenriched Precursors of cis-α,γ-Substituted-γ-Butyrolactones

A highly enantioselective one-pot synthesis of important building blocks, α-chiral γ-keto esters, has been developed by combining a quinine-catalyzed Michael addition of malononitrile to trans-enones followed by magnesium monoperoxyphthalate (MMPP) oxidat

Quinine catalysed asymmetric Michael additions in a sustainable solvent

Diethyl carbonate is shown to be a suitable, sustainable solvent in which to carry out quinine catalysed asymmetric Michael additions of malononitriles to enones. Both malonitrile and α-substituted malononitriles can be used as substrate and the results suggest that π-π stacking interactions between the (hetero)aromatic rings of the catalyst and substrates are important in determining the degree of asymmetric induction.