2-(3,4,5-Trimethoxyphenyl)ethanol

Base Information

• Chemical Name: 2-(3,4,5-Trimethoxyphenyl)ethanol
• CAS No.: 37785-48-1
• Molecular Formula: C11H16O4
• Molecular Weight: 212.246
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID30442090
• Nikkaji Number: J1.867.920E
• Wikidata: Q72513806
• Mol file: 37785-48-1.mol

Synonyms:37785-48-1;2-(3,4,5-trimethoxyphenyl)ethanol;3,4,5-Trimethoxyphenethyl alcohol;MFCD09926222;SCHEMBL5833688;DTXSID30442090;AKOS014196420;2-(3,4,5-trimethoxyphenyl)ethan-1-ol;DS-15793;SY021861;CS-0150625;EN300-1844914;A874011

Chemical Property of 2-(3,4,5-Trimethoxyphenyl)ethanol

Chemical Property:

• Melting Point: 100℃
• Boiling Point: 179-180 °C(Press: 11 Torr)
• PKA: 14.72±0.10(Predicted)
• PSA: 47.92000
• Density: 1.106±0.06 g/cm3 (20 ºC 760 Torr)
• LogP: 1.24720
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 212.10485899
• Heavy Atom Count: 15
• Complexity: 160

Purity/Quality:

99% ^*data from raw suppliers

2-(3,4,5-trimethoxyphenyl)ethanol 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1OC)OC)CCO

Technology Process of 2-(3,4,5-Trimethoxyphenyl)ethanol

There total 18 articles about 2-(3,4,5-Trimethoxyphenyl)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: 100.0%

methyl 2-(3,4,5-trimethoxyphenyl)acetate (2989-06-2) → 2-(3,4,5-trimethoxyphenyl)ethanol (37785-48-1)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 ℃; for 0.0833333h; Inert atmosphere;

DOI:10.1002/ejoc.201501624

Reference yield: 99.0%

→ 2-(3,4,5-trimethoxyphenyl)ethanol (37785-48-1)

Guidance literature:

With [ReOCl₂(1,2-bis(diphenylphosphino)ethane)]; hydrogen; potassium tetraphenylborate; In toluene; at 160 ℃; for 24h; under 30003 Torr; Autoclave; Inert atmosphere;

Reference yield: 90.0%

3,4,5-trimethoxyphenyl acetic acid (951-82-6) → 2-(3,4,5-trimethoxyphenyl)ethanol (37785-48-1)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 5 ℃; for 3h;

DOI:10.1002/cmdc.201000305

upstream raw materials:

diazomethane

4-hydroxy-3,5-dimethoxyphenethyl alcohol

mescaline hydrochloride

(3,4,5-trimethoxyphenyl)acetic acid ethyl ester

Downstream raw materials:

1-chloro-2-(3,4,5-trimethoxyphenyl)ethane

5,5-Dimethyl-3-[2-(3,4,5-trimethoxy-phenyl)-ethyl]-thiazolidine-2,4-dione

3,4,5-trimethoxyphenylacetaldehyde

1,2,3-Trimethoxy-5-[2-(4-nitro-phenoxy)-ethyl]-benzene

Refernces

• 1、 Braka, Abdenour,Chaloin, Laurent,Cros-Perrial, Emeline,Grosjean, Félix,Jordheim, Lars Petter,Mathé, Christophe,Peyrottes, Suzanne,Uttaro, Jean-Pierre. "Synthesis and Studies of Potential Inhibitors of CD73 Based on a Triazole Scaffold". supporting information. . Retrieved 2021/12/14.
• 2、 -. "PIPECOLIC ESTERS FOR INHIBITION OF THE PROTEASOME". Paragraph 00274; 00275. . Retrieved 2019/08/26.