4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile
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![4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ab2fd55307ef4629840db6abdfba60c4.png "4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile")
4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile
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CAS No:
58743-78-5
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Formula:
C15H13NO
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Chemical Name:
4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile
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Synonyms:
[1,1′-Biphenyl]-4-carbonitrile,4′-ethoxy-;4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile;4-Ethoxy-4′-cyanobiphenyl;4′-Ethoxy-[1,1′-biphenyl]-4-carbonitrile
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CAS No:
4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile Basic Attributes
223.27
223.27
261-417-3
DTXSID7069287
29269090
Safety Information
22-36/37/38
26-36/37-60
Xi
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501
H302+H312+H332
|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile Use and Manufacturing
General procedure: In a typical run, a mixture of aryl bromide (0.50 mmol), phenylboronic acid (0.55 mmol), K2CO3 (1.5 mmol), 0.2 molpercent ligand, 1 molpercent PdCl2(CH3CN)2 in 1.5 mL of ethanol were stirred at 50 C for 1.5 h under air. Solvent ethanol was removed completely under vacuum degree0.09 MPa at 45 C to give a crude product. The pure product was isolated by column chromatography on silica.To a solution of 4’-hydroxy-4-biphenylcarbonitrile (500 mg, 2.48 mmol) in acetone (50 mL) was added bromoethane (0.47 mL, 6.2 mmol) and K
Intermediates of Liquid Crystals
[1,1'-Biphenyl]-4-carbonitrile, 4'-ethoxy-: INACTIVE
Computed Properties
Molecular Weight:223.27
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:223.099714038
Monoisotopic Mass:223.099714038
Topological Polar Surface Area:33
Heavy Atom Count:17
Complexity:264
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4′-Ethoxy[1,1′-biphenyl]-4-carbonitrile
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