2-(4-Methoxyphenyl)propanal

Base Information

• Chemical Name: 2-(4-Methoxyphenyl)propanal
• CAS No.: 5405-83-4
• Molecular Formula: C10H12O2
• Molecular Weight: 164.2011
• European Community (EC) Number: 828-366-4
• NSC Number: 5235
• DSSTox Substance ID: DTXSID001288190
• Nikkaji Number: J30.867F
• Mol file: 5405-83-4.mol

Synonyms:2-(4-methoxyphenyl)propanal;5405-83-4;2-(4-methoxy-phenyl)-propionaldehyde;NSC5235;SCHEMBL615428;DTXSID001288190;NSC-5235;AKOS014313739;4-Methoxy-alpha-methylbenzeneacetaldehyde;EN300-124134;F1967-2634;Z1255380175

Chemical Property of 2-(4-Methoxyphenyl)propanal

Chemical Property:

• Vapor Pressure: 0.0141mmHg at 25°C
• Refractive Index: 1.5
• Boiling Point: 257.9 °C at 760 mmHg
• Flash Point: 108.3 °C
• Density: 1.02 g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 164.083729621
• Heavy Atom Count: 12
• Complexity: 137

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-(4-Methoxyphenyl)propanal

There total 86 articles about 2-(4-Methoxyphenyl)propanal 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: 97.2%

4-Methoxystyrene (637-69-4,24936-44-5) + carbon monoxide (201230-82-2) → 2-(4-methoxyphenyl)propanal (252058-33-6,305820-74-0,5405-83-4)

Guidance literature:

With hydrogen; In dichloromethane; at 45 ℃; for 14h; under 51716.2 Torr; regioselective reaction; Autoclave; Inert atmosphere; Green chemistry;

DOI:10.1039/c6ra03859j

Reference yield: 95.0%

anethole (104-46-1,25086-72-0,63589-56-0) → 2-(4-methoxyphenyl)propanal (252058-33-6,305820-74-0,5405-83-4)

Guidance literature:

With iodine; silver(l) oxide; In 1,4-dioxane; water; for 4h; Ambient temperature;

DOI:10.1246/cl.1984.341

Reference yield: 90.0%

1-methoxy-4-(1-methoxyprop-1-en-2-yl)benzene (191725-57-2) → 2-(4-methoxyphenyl)propanal (252058-33-6,305820-74-0,5405-83-4)

Guidance literature:

With hydrogen bromide; In water; acetone; at 0 - 23 ℃; for 46h;

DOI:10.1021/acs.orglett.5b01193

upstream raw materials:

1-isopropenyl-4-methoxybenzene

ethyl 3-(4-methoxyphenyl)-3-methyloxirane-2-carboxylate

1-methoxy-4-(1-methoxyprop-1-en-2-yl)benzene

1-(1,2-dibromopropyl)-4-methoxybenzene

Downstream raw materials:

2-(4-methoxy-phenyl)-propionaldehyde-oxime

2-(4-methoxy-phenyl)-propionaldehyde-semicarbazone

2-Hydroxymethyl-2-(4-methoxy-phenyl)-propan-1-ol

anti-ethyl 3-hydroxy-4-(4-methoxyphenyl)dithiopentanoate