N-(4-Iodophenyl)acetamide

Base Information

• Chemical Name: N-(4-Iodophenyl)acetamide
• CAS No.: 622-50-4
• Molecular Formula: C8H8 I N O
• Molecular Weight: 261.062
• Hs Code.: 29242998
• NSC Number: 2161
• DSSTox Substance ID: DTXSID7060752
• Nikkaji Number: J55.337I
• Wikidata: Q72484310
• Mol file: 622-50-4.mol

Synonyms:4-iodoacetanilide;p-iodoacetanilide;para-iodoacetanilide

Chemical Property of N-(4-Iodophenyl)acetamide

Chemical Property:

• Appearance/Colour: Bluish-grey to purple powder
• Melting Point: 182.0 to 187.0 °C
• Boiling Point: 180°C (rough estimate)
• PKA: 14.38±0.70(Predicted)
• Flash Point: 141.8oC
• PSA: 29.10000
• Density: 1.7396 (estimate)
• LogP: 2.32260
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: soluble in Methanol
• Water Solubility.: 182.7mg/L(25 oC)
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 260.96506
• Heavy Atom Count: 11
• Complexity: 141

Purity/Quality:

98% ^*data from raw suppliers

N-(4-Iodophenyl)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC=C(C=C1)I

Technology Process of N-(4-Iodophenyl)acetamide

There total 44 articles about N-(4-Iodophenyl)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: 99.0%

p-aminoiodobenzene (540-37-4) → 4-Acetamido-1-iodobenzene (622-50-4)

Guidance literature:

With pyridine; acetic anhydride; In ethyl acetate;

Reference yield: 96.0%

acetic anhydride (108-24-7) + p-aminoiodobenzene (540-37-4) → 4-Acetamido-1-iodobenzene (622-50-4)

Guidance literature:

With dmap; triethylamine; In dichloromethane; at 20 ℃; for 1h;

DOI:10.1016/j.cclet.2016.04.019

Reference yield: 93.0%

acetyl chloride (75-36-5) + p-aminoiodobenzene (540-37-4) → 4-Acetamido-1-iodobenzene (622-50-4)

Guidance literature:

With TEA; In tetrahydrofuran; at 0 - 30 ℃; for 12h; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.8b00410

upstream raw materials:

pyridine

1-(4-iodophenyl)urea

acetic anhydride

p-aminoiodobenzene

Downstream raw materials:

(E)-1-(4-acetamidophenyl)-2-phenylethene

N-[4-(1-Triisopropylsilanyl-1H-pyrrol-3-yl)-phenyl]-acetamide

N-[4-(3-Hydroxy-3-methyl-but-1-ynyl)-phenyl]-acetamide

(4-acetamidophenyl)diphenylphosphine

Refernces

• 1、 Kumar, Pushpendra,Patil, Shripad M.,Tandon, Nitin,Tandon, Runjhun. "Magnetically recyclable silica-coated ferrite magnetite-K10montmorillonite nanocatalyst and its applications in O, N, and S-acylation reaction under solvent-free conditions". . p. 21291 - 21300. Retrieved 2021/07/01.
• 2、 Digafie, Zeleke,Melaku, Yadessa,Belay, Zerihun,Eswaramoorthy, Rajalakshmanan. "Synthesis, Antibacterial, Antioxidant, and Molecular Modeling Studies of Novel [2,3′-Biquinoline]-4-Carboxylic Acid and Quinoline-3-Carbaldehyde Analogs". . . Retrieved 2021/05/19.