N-(4-acetylphenyl)propanamide

Base Information

• Chemical Name: N-(4-acetylphenyl)propanamide
• CAS No.: 7470-51-1
• Molecular Formula: C11H13NO2
• Molecular Weight: 191.2264
• Hs Code.: 2924299090
• NSC Number: 404311
• DSSTox Substance ID: DTXSID80323562
• Wikidata: Q82082645
• Mol file: 7470-51-1.mol

Synonyms:N-(4-acetylphenyl)propanamide;7470-51-1;N-(4-Acetylphenyl)propionamide;NSC404311;SCHEMBL7363709;DTXSID80323562;BBL014203;MFCD00032404;STK412621;AKOS000170400;NSC 404311;NSC-404311;VS-04237;EN300-708668;AG-205/04703038;Z27699565

Chemical Property of N-(4-acetylphenyl)propanamide

Chemical Property:

• Vapor Pressure: 1.58E-06mmHg at 25°C
• Boiling Point: 397.5°Cat760mmHg
• Flash Point: 173.4°C
• PSA: 46.17000
• Density: 1.121g/cm³
• LogP: 2.31070
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 191.094628657
• Heavy Atom Count: 14
• Complexity: 217

Purity/Quality:

98%min ^*data from raw suppliers

N-(4-Acetylphenyl)propanamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N-(4-acetylphenyl)propanamide

There total 2 articles about N-(4-acetylphenyl)propanamide 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:

propionyl chloride (79-03-8) + p-aminobenzophenone (99-92-3) → propionic acid-(4-acetyl-anilide) (7470-51-1)

Guidance literature:

With triethylamine; In N,N-dimethyl-formamide; at 0 ℃; Inert atmosphere;

DOI:10.1016/j.ejmech.2015.02.013

Reference yield:

iodobenzene (591-50-4) + N-(4-acetylphenyl)-2-propenamide (22535-53-1) → propionic acid-(4-acetyl-anilide) (7470-51-1) + C17H17NO2

Guidance literature:

With potassium phosphate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; tetramethylammonium formiate; P(p-C₆H₄F)3; In 1,4-dioxane; water; at 80 ℃; for 1h; Sealed tube;

DOI:10.1021/jacs.0c03040

Reference yield:

propionic acid-(4-acetyl-anilide) (7470-51-1) + thiosemicarbazide (79-19-6) → 1-(4-propionamidophenyl)ethylidenethiosemicarbazide

Guidance literature:

With acetic acid; In ethanol; at 50 - 80 ℃; for 3h;

DOI:10.1016/j.ejmech.2015.02.013

upstream raw materials:

propionyl chloride

p-aminobenzophenone

iodobenzene

N-(4-acetylphenyl)-2-propenamide

Refernces

• 1、 You, Ao,Zhou, Jie,Song, Senchuan,Zhu, Guoxun,Song, Huacan,Yi, Wei. "Structure-based modification of 3-/4-aminoacetophenones giving a profound change of activity on tyrosinase: From potent activators to highly efficient inhibitors". . p. 255 - 262. Retrieved 2015/03/04.