1-(4-Propylphenyl)propan-1-one

Base Information

• Chemical Name: 1-(4-Propylphenyl)propan-1-one
• CAS No.: 56147-30-9
• Molecular Formula: C12H16O
• Molecular Weight: 176.25
• Hs Code.: 2914399090
• DSSTox Substance ID: DTXSID50396182
• Mol file: 56147-30-9.mol

Synonyms:1-(4-propylphenyl)propan-1-one;56147-30-9;1-(4-propyl-phenyl)-propan-1-one;4-Propylpropiophenon;SCHEMBL10021819;DTXSID50396182;BBL017869;MFCD01993684;STK487811;AKOS000159584;VS-06560;CS-0314697

Chemical Property of 1-(4-Propylphenyl)propan-1-one

Chemical Property:

• Vapor Pressure: 0.00522mmHg at 25°C
• Refractive Index: 1.501
• Boiling Point: 275°C at 760 mmHg
• Flash Point: 112°C
• PSA: 17.07000
• Density: 0.943g/cm³
• LogP: 3.23180
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 176.120115130
• Heavy Atom Count: 13
• Complexity: 155

Purity/Quality:

98%Min ^*data from raw suppliers

1-(4-Propylphenyl)propan-1-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=CC=C(C=C1)C(=O)CC

Technology Process of 1-(4-Propylphenyl)propan-1-one

There total 5 articles about 1-(4-Propylphenyl)propan-1-one 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: 5.0%

α-chloro-4-propylpropiophenone (132560-67-9) → α-(4-propylphenyl)propanoic acid (3585-47-5) + 1-(4-propyl-phenyl)-propan-1-one (56147-30-9)

Guidance literature:

With methyloxirane; In water; acetone; Irradiation; pH neutral;

DOI:10.1016/S0040-4020(01)80835-8

Reference yield:

phenylpropane (103-65-1) + propionyl chloride (79-03-8) → 1-(4-propyl-phenyl)-propan-1-one (56147-30-9)

Guidance literature:

With carbon disulfide; aluminium trichloride;

DOI:10.1016/S0022-5347(05)67828-7

Reference yield:

phenylpropane (103-65-1) → 1-(4-propyl-phenyl)-propan-1-one (56147-30-9)

Guidance literature:

Multi-step reaction with 2 steps

1: AlCl₃

2: 5 percent / propylene oxide / H₂O; acetone / Irradiation; pH neutral

With aluminium trichloride; methyloxirane; In water; acetone;

DOI:10.1016/S0040-4020(01)80835-8

upstream raw materials:

phenylpropane

propionyl chloride

propionic acid anhydride

α-chloro-4-propylpropiophenone

Downstream raw materials:

1,4-di(n-propyl)benzene

1,1'-(1,4-phenylene)bis(propan-1-one)

C₁₂H₁₅BrO

1,4-Bis-(α-acetoxypropionyl)-benzol

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