3-Amino-5-methoxybenzonitrile
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3-Amino-5-methoxybenzonitrile
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CAS No:
269411-71-4
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Formula:
C8H8N2O
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Chemical Name:
3-Amino-5-methoxybenzonitrile
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Synonyms:
Benzonitrile,3-amino-5-methoxy-;3-Amino-5-methoxybenzonitrile;3-Cyano-5-methoxyaniline
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CAS No:
3-Amino-5-methoxybenzonitrile Use and Manufacturing
In the three bottle, Dissolve 3-methoxy-5-nitrobenzonitrile (8.0 g, 0.045 mol) in methanol (80 mL) and add 10percent palladium on carbon (1.4 g) and ammonium acetate (6.9 g, 0.090 mol). Hydrogen, reaction at 40 °C for 8 h. Reaction is complete, suction filtration, filter cakeWash with methanol (15 mL x 3). The filtrate was collected and concentrated under reduced pressure. The concentrate was poured into 50 mL of water and extracted with ethyl acetate (40 mL×3).Take, collect the organic phase, dry over anhydrous sodium sulfate, and evaporate the solvent under reduced pressure to obtain 3-amino-5-methoxybenzonitrile as a solid 6.5 g.98.2percentIn the three bottle, Dissolve 3-methoxy-5-nitrobenzonitrile (8.0 g, 0.045 mol) in methanol (80 mL) and add 10percent palladium on carbon (1.4 g) and ammonium acetate (6.9 g, 0.090 mol). Hydrogen, reaction at 40 °C for 8 h. Reaction is complete, suction filtration, filter cakeWash with methanol (15 mL x 3). The filtrate was collected and concentrated under reduced pressure. The concentrate was poured into 50 mL of water and extracted with ethyl acetate (40 mL×3).Take, collect the organic phase, dry over anhydrous sodium sulfate, and evaporate the solvent under reduced pressure to obtain 3-amino-5-methoxybenzonitrile as a solid 6.5 g.98.2percent
Computed Properties
Molecular Weight:148.16
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:148.063662883
Monoisotopic Mass:148.063662883
Topological Polar Surface Area:59
Heavy Atom Count:11
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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