N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide

Base Information

• Chemical Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide
• CAS No.: 27337-45-7
• Molecular Formula: C₁₅H₁₂N₂O₂
• Molecular Weight: 252.272
• DSSTox Substance ID: DTXSID401320710
• Nikkaji Number: J1.079.282G
• ChEMBL ID: CHEMBL125970

Synonyms:N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide;N-(4-Benzooxazol-2-yl-phenyl)-acetamide;Cambridge id 5250056;TimTec1_007046;Oprea1_089653;Oprea1_389758;27337-45-7;MLS001212587;CHEMBL125970;SCHEMBL2247579;UWXLQEOSAWVEHW-UHFFFAOYSA-N;DTXSID401320710;HMS1554A06;HMS2830L09;2-(4'-Acetamidophenyl)benzoxazole;STK391553;AKOS000638375;NCGC00276955-01;SMR000514243;n-(4-(benzo[d]oxazol-2-yl)phenyl)acetamide;AB00815368-06;SR-01000394321;SR-01000394321-1

Chemical Property of N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 252.089877630
• Heavy Atom Count: 19
• Complexity: 326

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2

Technology Process of N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide

There total 10 articles about N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

4-Acetylamino-N-(2-hydroxy-phenyl)-benzamide (3743-72-4) → N-(4-(benzo[d]oxazol-2-yl)phenyl)acetamide (27337-45-7)

Guidance literature:

With Al³⁺ exchanged K₁₀ clay; In 5,5-dimethyl-1,3-cyclohexadiene; at 140 ℃; for 16h; Green chemistry;

DOI:10.1016/j.tetlet.2013.09.039

Reference yield: 84.0%

benzoxazole (273-53-0,29791-96-6) + 5-(4-acetamidophenyl)-5H-thianthren-5-ium trifluoromethanesulfonate → N-(4-(benzo[d]oxazol-2-yl)phenyl)acetamide (27337-45-7)

Guidance literature:

With potassium phosphate; copper(I) bromide; bis(dibenzylideneacetone)-palladium⁽⁰⁾; nixantphos; In N,N-dimethyl acetamide; at 80 ℃; for 24h; Glovebox; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.1c01322

Reference yield: 75.0%

4-(benzo[d]oxazol-2-yl)aniline (20934-81-0) + acetic anhydride (108-24-7) → N-(4-(benzo[d]oxazol-2-yl)phenyl)acetamide (27337-45-7)

Guidance literature:

In benzene; for 4h; Heating;

DOI:10.1021/jm981076x

upstream raw materials:

4-(benzo[d]oxazol-2-yl)aniline

acetic anhydride

4-amino-benzoic acid

2-amino-phenol

Downstream raw materials:

4-(benzo[d]oxazol-2-yl)aniline

(3R)-6ξ-[(4-benzooxazol-2-yl-phenylcarbamoyl)-methyl]-5-oxo-thiomorpholine-3r-carboxylic acid ethyl ester

N-(4-benzooxazol-2-yl-phenyl)-succinimide

N-(4-benzooxazol-2-yl-phenyl)-maleimide

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