4'-Aminopropiophenone

Base Information

• Chemical Name: 4'-Aminopropiophenone
• CAS No.: 70-69-9
• Molecular Formula: C9H11 N O
• Molecular Weight: 149.192
• Hs Code.: 2922399090
• European Community (EC) Number: 200-742-7
• NSC Number: 404994,3187
• UN Number: 2811
• UNII: 79GF917W6U
• DSSTox Substance ID: DTXSID7021738
• Nikkaji Number: J11.069H
• Wikipedia: 4%27-Aminopropiophenone,4'-Aminopropiophenone
• Wikidata: Q4637033
• ChEMBL ID: CHEMBL3278330
• Mol file: 70-69-9.mol

Synonyms:4-aminopropiophenone;HCl of 4-aminopropiophenone;p-aminopropiophenone;para-aminopropiophenone

Chemical Property of 4'-Aminopropiophenone

Chemical Property:

• Appearance/Colour: yellow-brown crystalline powder, scales
• Melting Point: 135-140 °C
• Refractive Index: 1.5279 (estimate)
• Boiling Point: 305.8oC at 760 mmHg
• PKA: 2.86±0.10(Predicted)
• Flash Point: 138.7oC
• PSA: 43.09000
• Density: 1.067g/cm3
• LogP: 2.44270
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility.: 352.1mg/L(37.5 oC)
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 149.084063974
• Heavy Atom Count: 11
• Complexity: 137
• Transport DOT Label: Poison

Purity/Quality:

99% ^*data from raw suppliers

1-(4-Aminophenyl)propan-1-one 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25
• Safety Statements: 45-28A

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)C1=CC=C(C=C1)N
• Uses: 4''-Aminopropiophenone is used in method for preparing high-strength carbon nanotube film by thiol-ene click reaction.

Technology Process of 4'-Aminopropiophenone

There total 20 articles about 4'-Aminopropiophenone 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: 93.0%

1-(4-fluorophenyl)propan-1-one (456-03-1) → 1-(4-aminophenyl)-1-propanone (70-69-9)

Guidance literature:

With dipotassium peroxodisulfate; sodium azide; water; silver carbonate; In N,N-dimethyl-formamide; at 120 ℃; Sealed tube;

DOI:10.1039/c8ob01749b

Reference yield: 93.0%

4'-chloropropiophenone (6285-05-8) → 1-(4-aminophenyl)-1-propanone (70-69-9)

Guidance literature:

With C₄₆H₇₁Cl₃N₂Pd; ammonia; sodium t-butanolate; In 1,4-dioxane; at 80 ℃; for 2h; Inert atmosphere; Schlenk technique;

DOI:10.1021/acs.organomet.6b00830

Reference yield: 92.0%

4'-Bromopropiophenone (10342-83-3) → 1-(4-aminophenyl)-1-propanone (70-69-9)

Guidance literature:

4'-Bromopropiophenone; With bis(bis(trimethylsilyl)amido)zinc(II); tri-tert-butyl phosphine; lithium chloride; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In tetrahydrofuran; at 50 ℃; for 6h;

With hydrogenchloride; In tetrahydrofuran; diethyl ether;

DOI:10.1021/ol050141b

upstream raw materials:

4'-chloropropiophenone

N-(4-propionylphenyl)acetamide

N-(phenyl)-2-methylacetamide

1-(4-nitrophenyl)propan-1-one

Downstream raw materials:

propionic acid-(4-propionyl-anilide)

1-(4-phenacylamino-phenyl)-propan-1-one

(Propionyl-4-phenyl)-(methoxy-4'-phenyl)-amin

4-(N-Methylamino)propiophenon

Refernces

• 1、 Wang, Yu,Wei, Chenlong,Tang, Ruyun,Zhan, Haosheng,Lin, Jing,Liu, Zhenhua,Tao, Weihua,Fang, Zhongxue. "Silver-catalyzed intermolecular amination of fluoroarenes". supporting information. p. 6191 - 6194. Retrieved 2018/09/10.
• 2、 Borah, Ashwini,Goswami, Limi,Neog, Kashmiri,Gogoi, Pranjal. "DMF Dimethyl Acetal as Carbon Source for α-Methylation of Ketones: A Hydrogenation-Hydrogenolysis Strategy of Enaminones". . p. 4722 - 4728. Retrieved 2015/05/13.