1-(Pyridin-2-yl)propan-2-ol

Base Information

• Chemical Name: 1-(Pyridin-2-yl)propan-2-ol
• CAS No.: 5307-19-7
• Molecular Formula: C8H11 N O
• Molecular Weight: 137.181
• Hs Code.: 2933399090
• European Community (EC) Number: 801-640-0
• DSSTox Substance ID: DTXSID601311006
• Mol file: 5307-19-7.mol

Synonyms:1-(alpha-pyridine)-2-propanol;PGR-1

Chemical Property of 1-(Pyridin-2-yl)propan-2-ol

Chemical Property:

• Melting Point: 33°C
• Refractive Index: 1.5647 (estimate)
• Boiling Point: 260.2°Cat760mmHg
• Flash Point: 103.8°C
• PSA: 33.12000
• Density: 1.059g/cm³
• LogP: 1.00490
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 137.084063974
• Heavy Atom Count: 10
• Complexity: 95.3

Purity/Quality:

97% ^*data from raw suppliers

1-Pyridin-2-ylpropan-2-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC1=CC=CC=N1)O

Technology Process of 1-(Pyridin-2-yl)propan-2-ol

There total 2 articles about 1-(Pyridin-2-yl)propan-2-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:

2-acetonylpyridine (6302-02-9) → (α-hexahydropyridylidene)-propanone (60807-16-1) + isopelletierine (4396-01-4) + 1-pyridin-2-yl-propan-2-ol (5307-19-7)

Guidance literature:

With hydrogen; In tetrahydrofuran; at 30 ℃; for 4h; under 1500.15 Torr; Catalytic behavior; Autoclave; Glovebox;

DOI:10.1016/j.jcat.2017.08.010

Reference yield:

2-acetonylpyridine (6302-02-9) → (α-hexahydropyridylidene)-propanone (60807-16-1) + sedridine (10047-06-0) + isopelletierine (4396-01-4) + 1-pyridin-2-yl-propan-2-ol (5307-19-7)

Guidance literature:

With hydrogen; In tetrahydrofuran; at 30 ℃; for 1h; under 3750.38 Torr; Catalytic behavior; Autoclave; Glovebox;

DOI:10.1016/j.jcat.2017.08.010

Reference yield: 40.0%

bis(3,5-dimethylphenyl)(methyl)silane (1227475-37-7) + 1-pyridin-2-yl-propan-2-ol (5307-19-7) → (R)-2-(2-[bis(3,5-dimethylphenyl)methylsilanyloxy]propyl)pyridine (1227475-56-0) + (S)-2-(2-[bis(3,5-dimethylphenyl)methylsilanyloxy]propyl)pyridine + (S)-1-(pyridin-2-yl)propan-2-ol (14139-81-2)

Guidance literature:

With (3aR,8aR)-6-t-butyl-2,2-dimethyl-4,4,8,8-tetra(naphthalen-2-yl)tetrahydro[1,3]dioxolo[4,5-e]-[1,3,2]dioxaphosphepine; caesium carbonate; copper(l) chloride; In tetrahydrofuran; at 20 ℃; optical yield given as %ee; enantioselective reaction; Inert atmosphere;

DOI:10.1002/anie.200905561

upstream raw materials:

2-acetonylpyridine

Downstream raw materials:

(R)-2-(2-[bis(3,5-dimethylphenyl)methylsilanyloxy]propyl)pyridine

(S)-1-(pyridin-2-yl)propan-2-ol

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