No renderable structure data available
CC1=C(C=CC=C1N)CC#NChemical Intermediate
Structures, identifiers and computed properties have been matched to the database record by CAS.
| Intermediates | 2-(3-amino-2-methylphenyl)acetonitrile |
|---|---|
| IUPAC Name | — |
| CAS Number | 219312-27-3 |
| Database ID | 22170320 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-(3-amino-2-methylphenyl)acetonitrile (CAS 219312-27-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
Potential Applications
For professional research and industrial use only
Database ID 22170320
Safety Notice
For professional research and industrial use only. Review the supplier safety data sheet before handling.
Synthesis data
12 reactions · 12 references
Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-8127c0b2ec744c9c8d3a79186036b409Conditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-9f40806c7d0d42898e1dcfc849caf92bConditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-8127c0b2ec744c9c8d3a79186036b409Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (3-Amino-2-methyl-phenyl)-acetonitrile (11.1 g) was dissolved in 80 ml of pyridine. The solution was cooled in an ice bath and 11.3 g of methanesulfonyl chloride was added. The reaction mixture was removed from the ice bath and stirred at room temperature for 30 minutes; 10 ml of water was added, and the mixture was stirred for 30 minutes, poured into ethyl acetate (EtOAc), washed with cold hydrochloric acid, washed with water, dried, and evaporated to give 16.1 g of N-(3-cyanomethyl-2-methyl-phenyl)-methanesulfonamide as a light yellow solid. ##STR120## The solution was cooled in an ice bath The reaction mixture was removed from the ice bath 10 ml of water was added the mixture was stirred for 30 minutes poured into ethyl acetate (EtOAc) washed with cold hydrochloric acid washed with water dried evaporated
Source ID: ord-ab1d31a3f8484ee4815a227d25ae1cb0Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (2-Methyl-3-nitro-phenyl)-acetonitrile (16.6 g ) was dissolved in 400 ml of ethyl acetate and 0.83 g of 10% palladium on carbon (Degussa type) was added; and the reaction mixture was placed under 50 lb/in2 of hydrogen on the Parr shaker for 4 hr. The catalyst was filtered off; the solvent was evaporated; and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3), yielding 11.1 g of (3-amino-2-methyl-phenyl)-acetonitrile as a white solid. ##STR119## for 4 hr The catalyst was filtered off the solvent was evaporated and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3)
Source ID: ord-59276a29b2b049b59c58947aef75a872Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (2-Methyl-3-nitro-phenyl)-acetonitrile (16.6 g ) was dissolved in 400 ml of ethyl acetate and 0.83 g of 10% palladium on carbon (Degussa type) was added; and the reaction mixture was placed under 50 lb/in2 of hydrogen on the Parr shaker for 4 hr. The catalyst was filtered off; the solvent was evaporated; and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3), yielding 11.1 g of (3-amino-2-methyl-phenyl)-acetonitrile as a white solid. ##STR119## for 4 hr The catalyst was filtered off the solvent was evaporated and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3)
Source ID: ord-59276a29b2b049b59c58947aef75a872Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (3-Amino-2-methyl-phenyl)-acetonitrile (11.1 g) was dissolved in 80 ml of pyridine. The solution was cooled in an ice bath and 11.3g of methanesulfonyl chloride was added. The reaction mixture was removed from the ice bath and stirred at room temperature for 30 minutes; 10 ml of water was added, and the mixture was stirred for 30 minutes, poured into ethyl acetate (EtOAc), washed with cold hydrochloric acid, washed with water, dried, and evaporated to give 16.1 g of N-(3-cyanomethyl-2-methyl-phenyl)-methanesulfonamide as a light yellow solid. ##STR105## The solution was cooled in an ice bath The reaction mixture was removed from the ice bath 10 ml of water was added the mixture was stirred for 30 minutes poured into ethyl acetate (EtOAc) washed with cold hydrochloric acid washed with water dried evaporated
Source ID: ord-1dbd139f37134ff0961d6aa1f9c32186Conditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (2-Methyl-3-nitro-phenyl)-acetonitrile (16.6g ) was dissolved in 400 ml of ethyl acetate and 0.83g of 10% palladium on carbon (Degussa type) was added; and the reaction mixture was placed under 50 lb/in2 of hydrogen on the Parr shaker for 4 hr. The catalyst was filtered off; the solvent was evaporated; and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3), yielding 11.1 g of (3-amino-2-methyl-phenyl)-acetonitrile as a white solid. ##STR104## for 4 hr The catalyst was filtered off the solvent was evaporated and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3)
Source ID: ord-79b345418e2c47b1b797231e4457bedeConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (2-Methyl-3-nitro-phenyl)-acetonitrile (16.6g ) was dissolved in 400 ml of ethyl acetate and 0.83g of 10% palladium on carbon (Degussa type) was added; and the reaction mixture was placed under 50 lb/in2 of hydrogen on the Parr shaker for 4 hr. The catalyst was filtered off; the solvent was evaporated; and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3), yielding 11.1 g of (3-amino-2-methyl-phenyl)-acetonitrile as a white solid. ##STR104## for 4 hr The catalyst was filtered off the solvent was evaporated and the residue was purified by flash chromatography on silica gel eluting with ethyl acetate:hexane (2:3)
Source ID: ord-79b345418e2c47b1b797231e4457bedeConditions: temp:0.00; pressure:0.00; stir:
Source ID: ord-9f40806c7d0d42898e1dcfc849caf92bConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: 2-(2-Methyl-3-nitrophenyl)acetonitrile (Askam, V. et al. J. Chem. Soc. C (1969)1935–1936;) was hydrogenated over 5% palladium-charcoal 50 mg in EtOAc/EtOH 1:1 (14 ml) for three hours. The mixture was filtered through celite, and the filtrate was concentrated to give the title compound 77 mg (77%) as a white powder. The mixture was filtered through celite the filtrate was concentrated
Source ID: ord-c40df85708654243af8e209485f6c66eConditions: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
Procedure: (3-Amino-2-methyl-phenyl)-acetonitrile (11.1 g) was dissolved in 80 ml of pyridine. The solution was cooled in an ice bath and 11.3 g of methanesulfonyl chloride was added. The reaction mixture was removed from the ice bath and stirred at room temperature for 30 minutes; 10 ml of water was added, and the mixture was stirred for 30 minutes, poured into ethyl acetate (EtOAc), washed with cold hydrochloric acid, washed with water, dried, and evaporated to give 16.1 g of N-(3-cyanomethyl-2-methyl-phenyl)-methanesulfonamide as a light yellow solid. ##STR120## The solution was cooled in an ice bath The reaction mixture was removed from the ice bath 10 ml of water was added the mixture was stirred for 30 minutes poured into ethyl acetate (EtOAc) washed with cold hydrochloric acid washed with water dried evaporated
Source ID: ord-ab1d31a3f8484ee4815a227d25ae1cb0PubChem References
These sources are listed in the compound's public database record.
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