2-(3-Methoxyphenyl)ethanol

Base Information

• Chemical Name: 2-(3-Methoxyphenyl)ethanol
• CAS No.: 5020-41-7
• Molecular Formula: C9H12O2
• Molecular Weight: 152.193
• Hs Code.: 29094990
• European Community (EC) Number: 225-705-2
• NSC Number: 55877
• DSSTox Substance ID: DTXSID90198243
• Nikkaji Number: J209G
• Wikidata: Q72517597
• Mol file: 5020-41-7.mol

Synonyms:2-(3-Methoxyphenyl)ethanol;5020-41-7;3-Methoxyphenethyl alcohol;Benzeneethanol, 3-methoxy-;2-(3-methoxyphenyl)ethan-1-ol;Phenethyl alcohol, m-methoxy-;m-Methoxyphenethyl alcohol;m-Methoxyphenylethanol;1-(2-Hydroxyethyl)-3-methoxybenzene;2-(3-Methoxy-phenyl)-ethanol;EINECS 225-705-2;MFCD00002893;AI3-36527;3-methoxyphenethylalcohol;2-(m-Methoxyphenyl)ethanol;3-(2-Hydroxyethyl)anisole;SCHEMBL43521;2-(3-methoxyphenyl)-ethanol;DTXSID90198243;3-Methoxyphenethyl alcohol, 97%;CHEBI:194894;AMY28434;NSC55877;CK2455;NSC 55877;NSC-55877;AKOS009156828;CS-W008146;DS-16544;SY025589;FT-0671335;M2658;EN300-1250160

Chemical Property of 2-(3-Methoxyphenyl)ethanol

Chemical Property:

• Appearance/Colour: Clear colorless to pale yellow liquid
• Vapor Pressure: 0.00149mmHg at 25°C
• Refractive Index: n20/D 1.538(lit.)
• Boiling Point: 266.8 °C at 760 mmHg
• PKA: 14.89±0.10(Predicted)
• Flash Point: 109.8 °C
• PSA: 29.46000
• Density: 1.058 g/cm³
• LogP: 1.23000
• Storage Temp.: Refrigerator
• Solubility.: Chloroform
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 152.083729621
• Heavy Atom Count: 11
• Complexity: 104

Purity/Quality:

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

2-(3-Methoxyphenyl)ethanol ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)CCO
• Uses: 3-Methoxyphenethyl alcohol was used as starting reagent during the synthesis of 3-methoxy-2,6-dimethyl- phenethyl alcohol.

Technology Process of 2-(3-Methoxyphenyl)ethanol

There total 27 articles about 2-(3-Methoxyphenyl)ethanol 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: 98.0%

methyl (3-methoxyphenyl)acetate (18927-05-4) → 2-(3-methoxyphenyl)-ethanol (5020-41-7)

Guidance literature:

methyl (3-methoxyphenyl)acetate; With diethylzinc; lithium chloride; In tetrahydrofuran; hexane; at 20 ℃; for 6h; Inert atmosphere;

With sodium hydroxide; In tetrahydrofuran; hexane; water; at 20 ℃; for 8h; chemoselective reaction; Inert atmosphere;

DOI:10.1002/chem.201406176

Reference yield: 73.0%

1-(3-Methoxyphenyl)ethanone (586-37-8) → 2-(3-methoxyphenyl)-ethanol (5020-41-7)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 25 ℃; for 22h;

DOI:10.1021/jo00314a026

Reference yield: 62.0%

ethyleneglycol sulfate (1072-53-3) + 3-methoxyphenyl bromide (2398-37-0) → 2-(3-methoxyphenyl)-ethanol (5020-41-7)

Guidance literature:

3-methoxyphenyl bromide; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 2.5h;

ethyleneglycol sulfate; In tetrahydrofuran; hexane; at 20 ℃; for 16h;

With sulfuric acid; In tetrahydrofuran; hexane; for 47h; Further stages.; Heating;

DOI:10.1055/s-2008-1067021

upstream raw materials:

oxirane

(3-methoxyphenyl)magnesium bromide

ethanol

ETHYL 3-METHOXYPHENYLACETATE

Downstream raw materials:

3-methoxystyrene

3-methoxyphenethyl bromide

2-(3-hydroxyphenyl)ethanol

1-(2-chloroethyl)-3-methoxybenzene

Refernces

• 1、 Noro, Takahiro,Sakata, Juri,Tokuyama, Hidetoshi. "Synthetic studies on discorhabdin V: Construction of the A–F hexacyclic framework". supporting information. . Retrieved 2021/09/09.
• 2、 González-Delgado, José A.,Arteaga, Jesús F.. "Control of Homocoupling Versus Reduction in Titanium(III)-Mediated Radical Opening of Styrene Oxides". . p. 7864 - 7869. Retrieved 2019/12/27.