1-(3-Methoxyphenyl)but-3-en-1-ol

Base Information

• Chemical Name: 1-(3-Methoxyphenyl)but-3-en-1-ol
• CAS No.: 24165-65-9
• Molecular Formula: C11H14O2
• Molecular Weight: 178.231
• DSSTox Substance ID: DTXSID80444302
• Nikkaji Number: J867.893F
• Mol file: 24165-65-9.mol

Synonyms:1-(3-methoxyphenyl)but-3-en-1-ol;24165-65-9;1-(3-METHOXY-PHENYL)-BUT-3-EN-1-OL;SCHEMBL3232224;DTXSID80444302;XTHDDCLRIRAFLX-UHFFFAOYSA-N;3-Methoxy-alpha-allylbenzyl alcohol;1-(3-Methoxyphenyl)-3-buten-1-ol;4-(3-Methoxyphenyl)-1-buten-4-ol;AKOS010638304;SB85330;CS-0267217;EN300-375850

Chemical Property of 1-(3-Methoxyphenyl)but-3-en-1-ol

Chemical Property:

• Boiling Point: 102 °C(Press: 0.1 Torr)
• PKA: 14.29±0.20(Predicted)
• PSA: 29.46000
• Density: 1.032±0.06 g/cm3(Predicted)
• LogP: 2.30470
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 178.099379685
• Heavy Atom Count: 13
• Complexity: 156

Purity/Quality:

99% ^*data from raw suppliers

1-(3-METHOXY-PHENYL)-BUT-3-EN-1-OL ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-(3-Methoxyphenyl)but-3-en-1-ol

There total 16 articles about 1-(3-Methoxyphenyl)but-3-en-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%

allyltributylstanane (24850-33-7) + 3-methoxy-benzaldehyde (591-31-1) → 1-(3-methoxyphenyl)but-3-en-1-ol (24165-65-9)

Guidance literature:

With methylaluminium bis(4-bromo-2,6-di-tert.-butylphenoxide); In dichloromethane; at -20 ℃; for 0.75h;

DOI:10.1055/s-1999-2667

Reference yield: 98.0%

allyl bromide (106-95-6) + 3-methoxy-benzaldehyde (591-31-1) → 1-(3-methoxyphenyl)but-3-en-1-ol (24165-65-9)

Guidance literature:

allyl bromide; 3-methoxy-benzaldehyde; With tin(II) chloride dihdyrate; aluminium; In tetrahydrofuran; at 20 ℃; for 0.0833333h;

With water; In tetrahydrofuran; at 15 ℃; for 0.25h;

DOI:10.1016/j.tetlet.2013.09.096

Reference yield: 96.0%

allylmagnesium bromide (2622-05-1) + 3-methoxy-benzaldehyde (591-31-1) → 1-(3-methoxyphenyl)but-3-en-1-ol (24165-65-9)

Guidance literature:

In tetrahydrofuran; for 2.5h; Ambient temperature;

DOI:10.1021/ja963462e

upstream raw materials:

allyl bromide

3-methoxy-benzaldehyde

allylmagnesium bromide

tetraallyl tin

Downstream raw materials:

1-(3-methoxyphenyl)but-3-en-1-one

1-(3-methoxyphenyl)-3-butenyl acetate

1-(1-Allyloxybut-3-enyl)-3-methoxybenzene

C₁₄H₁₇BrO₂

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