26823-02-9

Basic information

• Product Name: 5-(4-METHOXYPHENYL)-5-OXOVALERONITRILE
• Synonyms: 5-(4-METHOXYPHENYL)-5-OXOVALERONITRILE
• CAS NO: 26823-02-9
• Molecular Formula: C₁₂H₁₃NO₂
• Molecular Weight: 203.24
• Mol File: 26823-02-9.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 394.1°C at 760 mmHg
• Flash Point: 172.4°C
• Appearance: /
• Density: 1.081g/cm³
• Vapor Pressure: 2.03E-06mmHg at 25°C
• Refractive Index: 1.516
• CAS DataBase Reference: 5-(4-METHOXYPHENYL)-5-OXOVALERONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 5-(4-METHOXYPHENYL)-5-OXOVALERONITRILE(26823-02-9)
• EPA Substance Registry System: 5-(4-METHOXYPHENYL)-5-OXOVALERONITRILE(26823-02-9)

Safety Data

• Hazardous Substances Data: 26823-02-9(Hazardous Substances Data)

Usage

InChI:InChI=1/C12H13NO2/c1-15-11-7-5-10(6-8-11)12(14)4-2-3-9-13/h5-8H,2-4H2,1H3

Upstream product

• 1116-98-9 cyanoacetic acid tert-butyl ester 
• 2138-33-2 3-(dimethylamino)-1-(4-methoxyphenyl)propan-1-one 
• 26823-01-8 2-Cyan-ethyl-malonsaeure 
• 100-07-2 4-methoxy-benzoyl chloride 
• 35747-19-4 ethyl 4-cyano-2-(4-methoxybenzoyl)butanoate 
• 544-13-8 Glutaronitrile 
• 5720-07-0 4-methoxyphenylboronic acid 
• 39201-33-7 4-cyanobutyric acid 
• 19158-51-1 P-toluenesulfonyl cyanide 
• 164171-80-6 1-(4-methoxyphenyl)cyclobutan-1-ol 
• 100-66-3 methoxybenzene 
• 108-55-4 glutaric anhydride, 
• 4609-10-3 5-(4-methoxyphenyl)-5-oxopentanoic acid 

Downstream Products

• 101284-22-4 [5-cyano-2-(4-methoxy-phenyl)-6-oxo-cyclohex-1-enyl]-acetic acid 
• 88687-21-2 7-Methoxy-5-(4-methyl-3-nitro-phenyl)-1,3,4,5-tetrahydro-indeno[1,2-b]pyridin-2-one 
• 135312-39-9 5-(4-Hydroxy-phenyl)-5-oxo-pentanenitrile 
• 81152-91-2 7-Methoxy-5-p-tolyl-1,3,4,5-tetrahydro-indeno[1,2-b]pyridin-2-one 
• 81152-90-1 5-(4-Chloro-phenyl)-7-methoxy-1,3,4,5-tetrahydro-indeno[1,2-b]pyridin-2-one 
• 81152-92-3 7-Methoxy-5-(4-nitro-phenyl)-1,3,4,5-tetrahydro-indeno[1,2-b]pyridin-2-one 
• 88687-22-3 5-(4-Dimethylamino-phenyl)-7-methoxy-1,3,4,5-tetrahydro-indeno[1,2-b]pyridin-2-one 
• 88687-20-1 5-(4-Isopropyl-phenyl)-7-methoxy-1,3,4,5-tetrahydro-indeno[1,2-b]pyridin-2-one 
• 88687-28-9 (4aS,5S,9bS)-5-(4-Isopropyl-phenyl)-7-methoxy-1,3,4,4a,5,9b-hexahydro-indeno[1,2-b]pyridin-2-one 
• 88687-27-8 (4aS,5S,9bS)-5-(3-Amino-4-methyl-phenyl)-7-methoxy-1,3,4,4a,5,9b-hexahydro-indeno[1,2-b]pyridin-2-one 
• 88687-29-0 (4aS,5S,9bS)-5-(4-Dimethylamino-phenyl)-7-methoxy-1,3,4,4a,5,9b-hexahydro-indeno[1,2-b]pyridin-2-one 
• 88763-27-3 (4aS,5S,9bS)-5-(3-Amino-4-methyl-phenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-7-ol 
• 88763-31-9 (4aS,5S,9bS)-5-(4-Isopropyl-phenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-7-ol 
• 88763-29-5 (4aS,5S,9bS)-5-(4-Isopropyl-phenyl)-7-methoxy-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridine 

Relevant articles and documents

Syntheses of Pyrroles, Pyridines, and Ketonitriles via Catalytic Carbopalladation of Dinitriles

The first example of the Pd-catalyzed addition of organoboron reagents to dinitriles, as an efficient means of preparing 2,5-diarylpyrroles and 2,6-diarylpyridines, has been discussed here. Furthermore, the highly selective carbopalladation of dinitriles with organoboron reagents to give long-chain ketonitriles has been developed as well. Based on the broad scope of substrates, excellent functional group tolerance, and use of commercially available substrates, the Pd-catalyzed addition reaction of arylboronic acid and dinitriles is expected to be significant in future synthetic procedures.

Nickel-Catalyzed Reductive Electrophilic Ring Opening of Cycloketone Oxime Esters with Aroyl Chlorides

By merging cross-electrophile coupling and C-C bond cleavage, we developed a Ni-catalyzed electrophilic ring opening of cycloketone oxime esters with aromatic acid chlorides in assistance of Mn as reductant. Notably, complete regioselectivity can be achieved in this C-C bond cleavage reaction, providing an efficient access to a variety of cyanoketones under cyanide-free conditions. A radical reaction pathway was proposed on the basis of the results of the mechanistic probing experiments.

Enantioselective titanium(III)-catalyzed reductive cyclization of ketonitriles

Reduction, please! The title reaction affords ?-hydroxyketones, a common structural motif in biologically active natural products, in good yields and high enantioselectivities at room temperature. The commercially available ansa-titanocene 1 was found to be an efficient catalyst for this process, which presumably proceeds by addition of a ketyl radical to a nitrile.