3-(4-Methoxyphenyl)propan-1-ol

Base Information

• Chemical Name: 3-(4-Methoxyphenyl)propan-1-ol
• CAS No.: 5406-18-8
• Molecular Formula: C10H14O2
• Molecular Weight: 166.22
• Hs Code.: 2909499000
• European Community (EC) Number: 226-463-0
• NSC Number: 5311
• UNII: S9PVU97PBV
• DSSTox Substance ID: DTXSID20202382
• Nikkaji Number: J217.970I
• Wikidata: Q83075659
• Mol file: 5406-18-8.mol

Synonyms:3-(4-methoxyphenyl)propan-1-ol

Chemical Property of 3-(4-Methoxyphenyl)propan-1-ol

Chemical Property:

• Vapor Pressure: 0.00145mmHg at 25°C
• Melting Point: 26 °C
• Refractive Index: n20/D 1.532(lit.)
• Boiling Point: 283.9 °C at 760 mmHg
• PKA: 15.08±0.10(Predicted)
• Flash Point: 122.3 °C
• PSA: 29.46000
• Density: 1.037 g/cm³
• LogP: 1.62010
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 166.099379685
• Heavy Atom Count: 12
• Complexity: 106

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-(4-Methoxyphenyl)-1-propanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CCCO

Technology Process of 3-(4-Methoxyphenyl)propan-1-ol

There total 88 articles about 3-(4-Methoxyphenyl)propan-1-ol 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%

ethyl 3-(4-methoxyphenyl)propanoate (22767-72-2) → 3-(p-methoxyphenyl)-1-propanol (5406-18-8)

Guidance literature:

With methanol; Na/SiO₂; In tetrahydrofuran; at 0 - 25 ℃; Inert atmosphere;

DOI:10.1021/jo802778z

Reference yield: 98.0%

methyl p-methoxycinnamate (832-01-9,3901-07-3,19310-29-3) → 3-(p-methoxyphenyl)-1-propanol (5406-18-8)

Guidance literature:

With methanol; Na/SiO₂; In tetrahydrofuran; at 0 - 25 ℃; Inert atmosphere;

DOI:10.1021/jo802778z

Reference yield: 98.0%

C16H28O2Si (1010079-18-1) → 3-(p-methoxyphenyl)-1-propanol (5406-18-8)

Guidance literature:

With 1-methyl-1-[4-(3-phenyl-propoxymethyl)-phenyl]-siletane; In tetrahydrofuran; water; acetic acid; for 4h;

DOI:10.1021/jo802229p

upstream raw materials:

ethanol

ethyl (E)-3-(4-methoxyphenyl)prop-2-enoate

ethyl 3-(4-methoxyphenyl)propanoate

3-(4-methoxy-phenyl)propionamide

Downstream raw materials:

ethyl (E)-5-(4-methoxyphenyl)pent-2-enoate

Methanesulfonic acid (E)-5-(4-methoxy-phenyl)-pent-2-enyl ester

1-((E)-7-Bromo-hept-3-enyl)-4-methoxy-benzene

methyl E-7-(4-methoxyphenyl)hept-4-enoate

Refernces

• 1、 Ahmad, Mohammad N.,Chopra, Sidharth,Fernandes, Rodney A.,Kumar, Praveen. "Catalytic δ-hydroxyalkynone rearrangement in the stereoselective total synthesis of centrolobine, engelheptanoxides A and C and analogues". . . Retrieved 2021/08/13.
• 2、 Nouaille, Augustin,Pannecoucke, Xavier,Poisson, Thomas,Couve-Bonnaire, Samuel. "Access to Trisubstituted Fluoroalkenes by Ruthenium-Catalyzed Cross-Metathesis". supporting information. p. 2140 - 2147. Retrieved 2021/03/06.