N-(4-Phenoxyphenyl)acetamide
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N-(4-Phenoxyphenyl)acetamide
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CAS No:
6312-87-4
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Formula:
C14H13NO2
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Chemical Name:
N-(4-Phenoxyphenyl)acetamide
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Synonyms:
Acetamide,N-(4-phenoxyphenyl)-;Acetanilide,4′-phenoxy-;N-(4-Phenoxyphenyl)acetamide;4′-Phenoxyacetanilide;4-Acetylaminodiphenyl ether;4-(Acetylamino)-1,1′-diphenyl ether;NSC 40576;N-Acetyl-4-phenoxyaniline
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CAS No:
N-(4-Phenoxyphenyl)acetamide Basic Attributes
227.26
227.26
CSE7U756DE
40576
DTXSID20212461
2924299090
Safety Information
P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P313, P363, P501
H317
|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P313, P363, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
N-(4-Phenoxyphenyl)acetamide Use and Manufacturing
General procedure: A mixture of aryl diazonium tetrafluoroborates compounds (0.5 mmol), nitriles (0.5 mmol), HCommercial available 4-phenoxy-aniline (4.16 g, 20.8 mmol) was dissolved in dichloromethane (100 mL), and triethylamine (3.05 g, 31.1 mmol) and acetic anhydride (2.22 g, 20.8 mmol) were added in drops. The mixture was stirred for 1 h at 0° C. to room temperature. After completion of the reaction, the mixture was filtered using dichloromethane and crystallized to give the title compound (4.50 g, 18.6 mmol)N- (4-phenoxyphenyl) acetamide: A mixture of 142.5 mg (0.5 mmol) of 4-phenoxyphenyl diazonium tetrafluoroborate, 0.1 mmol of copper iodide, 0.5 mmol of phosphoric acid potassium and 1.0 mmol of water was added in a Schlenk tube under a nitrogen atmosphere, the 1 mL of acetonitrile under air conditions at 80 °C was stirred for 12 hours, the reaction yield of 58percent.
Computed Properties
Molecular Weight:227.26
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:227.094628657
Monoisotopic Mass:227.094628657
Topological Polar Surface Area:38.3
Heavy Atom Count:17
Complexity:241
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes