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

Base Information

• Chemical Name: 1-(3-Methoxyphenyl)propan-1-ol
• CAS No.: 52956-27-1
• Molecular Formula: C10H14O2
• Molecular Weight: 166.22
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID50415680
• Nikkaji Number: J1.576.976I
• Mol file: 52956-27-1.mol

Synonyms:1-(3-methoxyphenyl)propan-1-ol;52956-27-1;1-(3-Methoxyphenyl)-1-propanol;(S)-1-(3-Methoxyphenyl)propanol;ghl.PD_Mitscher_leg0.1287;SCHEMBL801059;1-(3-Methoxyphenyl)1-propanol;DTXSID50415680;OTBXPRJLIYBQHF-UHFFFAOYSA-N;CCA95627;1-(3'-methoxyphenyl)-propan-1-ol;MFCD11521209;AKOS010016516;CS-0378438;EN300-83887;N12603;A923390;Z513748112

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

Chemical Property:

• PSA: 29.46000
• LogP: 2.13860
• Storage Temp.: 2-8°C
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 166.099379685
• Heavy Atom Count: 12
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

1-(3-methoxyphenyl)propan-1-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1=CC(=CC=C1)OC)O
• Use Description: Benzenemethanol, α-ethyl-3-methoxy-, is a chemical compound with applications in various fields. In the field of pharmaceuticals and drug development, it can serve as an important intermediate for the synthesis of various pharmaceutical compounds. Its role is pivotal in the creation of organic molecules with potential therapeutic properties, contributing to the development of medications for a wide range of medical conditions. Additionally, in the realm of organic chemistry and chemical research, this compound can be used as a building block for the synthesis of complex organic molecules, aiding in the study of organic reactions and the development of new synthetic pathways. Its multifaceted utility underscores its significance in advancing pharmaceutical research, chemical synthesis, and scientific investigation, where it plays a crucial role in drug discovery, compound synthesis, and chemical exploration.

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

There total 13 articles about 1-(3-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: 100.0%

diethylzinc (557-20-0) + 3-methoxy-benzaldehyde (591-31-1) → 1-(3-methoxyphenyl)propanol (52956-27-1)

Guidance literature:

With (R,R)-(2,4,6-Me₃C₆H₂-CH=N-CH(Ph))2; (R)-(+)-3,3'-diphenyl-[1,1'-binaphthalene]-2,2'-diol; In hexane; dichloromethane; 1.) -78 deg C, 4 h, 2.) -20 deg, 1 h;

DOI:10.1002/(SICI)1521-3773(19990215)38:4<497::AID-ANIE497>3.0.CO;2-G

Reference yield: 99.0%

ethylmagnesium bromide (925-90-6) + 3-methoxy-benzaldehyde (591-31-1) → 1-(3-methoxyphenyl)propanol (52956-27-1)

Guidance literature:

In tetrahydrofuran; 1) -78 deg C, 10 min, 2) RT, 2 h;

DOI:10.1021/jo00048a029

Reference yield: 99.0%

1-(3-methoxyphenyl)propan-1-one (37951-49-8) → 1-(3-methoxyphenyl)propanol (52956-27-1)

Guidance literature:

With methanol; bis[dichloro(pentamethylcyclopentadienyl)iridium(III)]; 6,6′‐dihydroxyl‐2,2′‐bipyridine; potassium hydroxide; at 60 ℃; for 24h; Inert atmosphere;

DOI:10.1002/cctc.202000228

upstream raw materials:

ethylmagnesium iodide

3-methoxy-benzaldehyde

ethylmagnesium bromide

ethyl bromide

Downstream raw materials:

2-methyl-6-(methyloxy)-3-[3-(methyloxy)phenyl]thieno[2,3-b]pyridin-4-amine

4-amino-2-methyl-3-[3-(methyloxy)phenyl]thieno[2,3-b]pyridin-6(7H)-one

methyl 4-amino-2-methyl-3-[3-(methyloxy)phenyl]-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

4-chloro-N-{2,6-dimethyl-3-[3-(methyloxy)phenyl]thieno[2,3-b]pyridin-4-yl}-4-piperidinesulfonamide

Refernces

• 1、 Garg, Nidhi,Paira, Soumen,Sundararaju, Basker. "Efficient Transfer Hydrogenation of Ketones using Methanol as Liquid Organic Hydrogen Carrier". . p. 3472 - 3476. Retrieved 2020/05/29.
• 2、 Borah, Ashwini,Goswami, Limi,Neog, Kashmiri,Gogoi, Pranjal. "DMF Dimethyl Acetal as Carbon Source for α-Methylation of Ketones: A Hydrogenation-Hydrogenolysis Strategy of Enaminones". . p. 4722 - 4728. Retrieved 2015/05/13.