1-(4-Methoxyphenyl)ethanol

Base Information

• Chemical Name: 1-(4-Methoxyphenyl)ethanol
• CAS No.: 3319-15-1
• Molecular Formula: C9H12O2
• Molecular Weight: 152.193
• Hs Code.: 2909499000
• European Community (EC) Number: 222-019-5
• NSC Number: 406712
• UNII: 018M85FD11
• DSSTox Substance ID: DTXSID401311686
• Nikkaji Number: J205.401I
• Wikidata: Q27159251
• Metabolomics Workbench ID: 68062
• Mol file: 3319-15-1.mol

Synonyms:1-(4-Methoxyphenyl)ethanol;3319-15-1;4-Methoxy-alpha-methylbenzyl alcohol;1-(4-methoxyphenyl)ethan-1-ol;4-Methoxyphenyl methyl carbinol;1-(p-Methoxyphenyl)ethanol;4-Methoxy-.alpha.-methylbenzyl alcohol;1-(4-methoxyphenyl)-ethanol;EINECS 222-019-5;(+/-)-1-(4-methoxyphenyl)ethanol;MFCD00016857;018M85FD11;NSC-406712;1-(4-Methoxyphenyl)ethanol, (+/-)-;AI3-05520;Benzenemethanol, 4-methoxy-.alpha.-methyl-;MFCD09863666;MFCD09863667;NSC406712;4-methoxyphenyl ethanol;bmse010136;C(C)(O)c1ccc(OC)cc1;1-(P-ANISYL)ETHANOL;1-(4-methoxy-phenyl)ethanol;1-(4-methoxyphenyl) ethanol;SCHEMBL931283;1-(4-Methoxyphenyl)ethanol #;4-methoxy--methylbenzyl alcohol;UNII-018M85FD11;CHEBI:86566;DTXSID401311686;alpha-methyl-4-methoxybenzyl alcohol;AKOS000249013;AKOS016050377;4-Methoxy- alpha -methylbenzyl alcohol;NSC 406712;Benzenemethanol, 4-methoxy-alpha-methyl-;(S)-alpha-Methyl-4-methoxybenzyl Alcohol;DS-11602;SY114791;SY194794;4-Methoxy-alpha-methylbenzyl alcohol, 99%;CS-0154099;FT-0622181;FT-0688889;EN300-50553;.ALPHA.-METHYL-4-METHOXYBENZYL ALCOHOL;4-METHOXY-.ALPHA.-METHYLBENZENEMETHANOL;D70953;A821654;W-106785;Q27159251;Z335245134

Chemical Property of 1-(4-Methoxyphenyl)ethanol

Chemical Property:

• Appearance/Colour: liquid
• Vapor Pressure: 0.00899mmHg at 25°C
• Refractive Index: n20/D 1.533(lit.)
• Boiling Point: 254.3 °C at 760 mmHg
• PKA: 14.49±0.20(Predicted)
• Flash Point: 108 °C
• PSA: 29.46000
• Density: 1.053 g/cm³
• LogP: 1.74850
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform, Ethyl Acetate (Slightly), Methanol (Sparingly)
• Water Solubility.: Not miscible in water.
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 152.083729621
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

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

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

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C1=CC=C(C=C1)OC)O
• Uses: 1-(4-Methoxyphenyl)ethanol is used to study the steady-state and nanosecond, laser-flash photolysis. It is used to produce 4-(1-chloro-ethyl)-anisole. 4-Methoxy-α-methylbenzyl alcohol was used to study the steady-state and nanosecond, laser-flash photolysis.

Technology Process of 1-(4-Methoxyphenyl)ethanol

There total 309 articles about 1-(4-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: 97.0%

4-Methoxystyrene (637-69-4,24936-44-5) → rac-1-(4-methoxyphenyl)-ethanol (3319-15-1) + 1-(4-methoxyphenyl)ethanone (100-06-1)

Guidance literature:

With 2.9-dimethyl-1,10-phenanthroline; phenylsilane; iron(II) chloride; In ethanol; at 20 ℃; for 4.5h; Reagent/catalyst;

DOI:10.1002/anie.202103222

Reference yield: 82.0%

p-ethylanisole (1515-95-3) → rac-1-(4-methoxyphenyl)-ethanol (3319-15-1) + 1-(4-methoxyphenyl)ethanone (100-06-1)

Guidance literature:

With 1-hydroxy-1,2-benzodioxol-3-(1H)-one; tris(2,2'-bipyridyl)ruthenium dichloride; water; at 30 ℃; for 10h; Irradiation; Inert atmosphere;

DOI:10.1039/c7sc02773g

Reference yield: 80.0%

isopropyl butyrate (638-11-9) + rac-1-(4-methoxyphenyl)-ethanol (3319-15-1) → (S)-1-(4-Methoxyphenyl)ethanol (1517-70-0,1572-97-0,3319-15-1,43230-31-5) + (R)-1-(4-Methoxyphenyl)ethanol (1517-70-0) + 1-(4-methoxyphenyl)ethanone (100-06-1) + (R)-α-methyl-4-methoxybenzyl butyrate

Guidance literature:

With [(C4Ph4COHOCC4Ph4)(μ-H)][(CO)4Ru2]; Novozym(R) 435; 2,4-dimethylpentan-3-one; In toluene; at 70 ℃; for 40h; under 142.511 Torr;

DOI:10.1016/j.tetasy.2005.02.028

upstream raw materials:

2-(4-methoxyphenyl)oxirane

methyl magnesium iodide

4-methoxymandelonitrile

diethyl ether

Downstream raw materials:

4-Methoxystyrene

1-methoxy-4-(1-(1-(4-methoxyphenyl)ethoxy)-ethyl)benzene

1-(4-methoxyphenyl)ethanone

1-methoxy-4-(1-methoxy-ethyl)-benzene

Refernces

• 1、 Lee et al.. "". . p. 441,442. Retrieved 1968.
• 2、 Gawande, Manoj B.,Rathi, Anuj K.,Branco, Paula S.,Potewar,Velhinho, Alexandre,Nogueira, Isabel D.,Tolstogouzov, Alexander,Ghumman, C. Amjad A.,Teodoro, Orlando M.N.D.. "Nano-MgO-ZrO2 mixed metal oxides: Characterization by SIMS and application in the reduction of carbonyl compounds and in multicomponent reactions". . p. 3611 - 3617. Retrieved 2013.
• 3、 He, Bingbing,Tang, Fengci,Sun, Chenrui,Su, Jiahao,Wu, Bingcheng,Chen, Yan,Xiao, Yuquan,Zhang, Panliang,Tang, Kewen. "Resolution of (R,S)-1-(4-methoxyphenyl)ethanol by lipase-catalyzed stereoselective transesterification and the process optimization". . p. 438 - 445. Retrieved 2021/12/17.
• 4、 Kataeva, Olga,Kn?lker, Hans-Joachim,Linke, Philipp,Puls, Florian. "Iron-Catalyzed Wacker-type Oxidation of Olefins at Room Temperature with 1,3-Diketones or Neocuproine as Ligands**". supporting information. p. 14083 - 14090. Retrieved 2021/05/24.