N-[4-(1-Cyanoethyl)phenyl]acetamide
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![N-[4-(1-Cyanoethyl)phenyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3ba24a1497f5453991ff4603a0a39471.png "N-[4-(1-Cyanoethyl)phenyl]acetamide")
N-[4-(1-Cyanoethyl)phenyl]acetamide
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CAS No:
28694-91-9
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Formula:
C11H12N2O
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Chemical Name:
N-[4-(1-Cyanoethyl)phenyl]acetamide
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Synonyms:
Acetamide,N-[4-(1-cyanoethyl)phenyl]-;Acetanilide,4′-(1-cyanoethyl)-;N-[4-(1-Cyanoethyl)phenyl]acetamide;2-(4-Acetamidophenyl)propionitrile
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CAS No:
N-[4-(1-Cyanoethyl)phenyl]acetamide Use and Manufacturing
Methyl benzyl acetonitrile with dimethyl sulfate to generate 2-phenylpropionitrile, then nitrate with mixed acid, reduce and acetylate to obtain the product.
Intermediates of pirprofen and flupirprofen.
Computed Properties
Molecular Weight:188.23
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:188.094963011
Monoisotopic Mass:188.094963011
Topological Polar Surface Area:52.9
Heavy Atom Count:14
Complexity:245
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
N-[4-(1-Cyanoethyl)phenyl]acetamide
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