2-Amino-1-(3,5-dimethoxyphenyl)ethanol

Base Information

• Chemical Name: 2-Amino-1-(3,5-dimethoxyphenyl)ethanol
• CAS No.: 91252-41-4
• Molecular Formula: C10H15NO3
• Molecular Weight: 197.234
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID20397666
• Nikkaji Number: J532.145J
• Mol file: 91252-41-4.mol

Synonyms:91252-41-4;2-amino-1-(3,5-dimethoxyphenyl)ethanol;2-Hydroxy-2-(3,5-dimethoxyphenyl)ethylamine;2-amino-1-(3,5-dimethoxyphenyl)ethan-1-ol;2-Amino-1-[3,5-dimethoxyphenyl]ethanol;AR2897;SCHEMBL2082408;DTXSID20397666;UOBUBYADHSKKDW-UHFFFAOYSA-N;MFCD03840178;AKOS000123368;AKOS022483672;AS-45473;CS-0172562;FT-0718932;EN300-80690;A916358;2-hydroxy-2-(3,5-dimethoxyphenyl)ethylamine, AldrichCPR

Chemical Property of 2-Amino-1-(3,5-dimethoxyphenyl)ethanol

Chemical Property:

• PSA: 64.71000
• LogP: 1.39620
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 197.10519334
• Heavy Atom Count: 14
• Complexity: 153

Purity/Quality:

99% ^*data from raw suppliers

2-HYDROXY-2-(3,5-DIMETHOXYPHENYL)ETHYLAMINE 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-Amino-1-(3,5-dimethoxyphenyl)ethanol

There total 4 articles about 2-Amino-1-(3,5-dimethoxyphenyl)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: 59.0%

→ 2-hydroxy-2-(3,5-dimethoxyphenyl)ethylamine (91252-41-4)

Guidance literature:

Reference yield:

1-(1-hydroxy-2-nitroethyl)-3,5-dimethoxybenzene (124471-31-4) → 2-hydroxy-2-(3,5-dimethoxyphenyl)ethylamine (91252-41-4)

Guidance literature:

With palladium on activated charcoal; hydrogen; In methanol; at 20 ℃; for 12h;

Reference yield:

3,5-dimethoxybenzaldehdye (7311-34-4) → 2-hydroxy-2-(3,5-dimethoxyphenyl)ethylamine (91252-41-4)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / 12 h / 20 °C

2: palladium on activated charcoal; hydrogen / methanol / 12 h / 20 °C

With palladium on activated charcoal; hydrogen; triethylamine; In methanol;

upstream raw materials:

1-(1-hydroxy-2-nitroethyl)-3,5-dimethoxybenzene

3,5-dimethoxybenzaldehdye

Downstream raw materials:

(5R)-5-benzyl-N-[2-(3,5-dimethoxyphenyl)-2-hydroxyethyl]-2,4-dioxo-3-[(1R)-1-phenylethyl]-1,3-oxazolidine-5-carboxamide

Refernces

• 1、 -. "MORPHOLINE DOPAMINE AGONISTS FOR THE TREATMENT OF PAIN". Page/Page column 40. . Retrieved 2008/12/07.
• 2、 Thiele,Posselt,von Bebenburg. "New piperidine derivatives from cardio-active beta-aminoketones. Synthesis and structure of a metabolite of oxyfedrine". . p. 1263 - 1269. Retrieved 2007/10/04.