2-Methyl-2-(pyridin-4-yl)propan-1-ol

Base Information

• Chemical Name: 2-Methyl-2-(pyridin-4-yl)propan-1-ol
• CAS No.: 34995-28-3
• Molecular Formula: C9H13NO
• Molecular Weight: 151.21
• DSSTox Substance ID: DTXSID70541793
• Wikidata: Q82418233
• Mol file: 34995-28-3.mol

Synonyms:34995-28-3;2-Methyl-2-(pyridin-4-yl)propan-1-ol;2-methyl-2-(4-pyridyl)-1-propanol;2-methyl-2-pyridin-4-ylpropan-1-ol;SCHEMBL10487429;DTXSID70541793;NNHHDNWAQPDOHZ-UHFFFAOYSA-N;2-methyl-2-pyrid-4-ylpropan-1-ol;4-(1,1-Dimethyl-2-hydroxyethyl)pyridine

Chemical Property of 2-Methyl-2-(pyridin-4-yl)propan-1-ol

Chemical Property:

• PSA: 33.12000
• LogP: 1.35150
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 151.099714038
• Heavy Atom Count: 11
• Complexity: 117

Purity/Quality:

99% ^*data from raw suppliers

b,b-dimethyl-4-Pyridineethanol 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CO)C1=CC=NC=C1

Technology Process of 2-Methyl-2-(pyridin-4-yl)propan-1-ol

There total 4 articles about 2-Methyl-2-(pyridin-4-yl)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: 84.0%

4-s-propylpyridine (696-30-0) + formaldehyd (50-00-0,30525-89-4,61233-19-0) → 2-methyl-2-(4-pyridyl)-1-propanol (34995-28-3)

Guidance literature:

In water; Heating;

DOI:10.1021/jo00229a001

Reference yield: 20.0%

4-s-propylpyridine (696-30-0) + acetic anhydride (108-24-7) + dimethyl sulfoxide (67-68-5,8070-53-9) → 2-methyl-2-(4-pyridyl)-1-propanol (34995-28-3) + Acetic acid 2-methyl-2-pyridin-4-yl-propyl ester (120414-14-4)

Guidance literature:

In acetic acid; at 120 ℃; for 24h;

DOI:10.1016/S0040-4039(00)80563-8

Reference yield:

2-methyl-2-pyridin-4-ylpropionic acid ethyl ester (205044-48-0) → 2-methyl-2-(4-pyridyl)-1-propanol (34995-28-3)

Guidance literature:

With diisobutylaluminium hydride; In tetrahydrofuran; toluene; at 10 - 20 ℃;

upstream raw materials:

4-s-propylpyridine

acetic anhydride

dimethyl sulfoxide

formaldehyd

Downstream raw materials:

1-chloro-2-methyl-2-(4-pyridyl)propane

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