1-(Pyrimidin-5-yl)ethan-1-ol

Base Information

• Chemical Name: 1-(Pyrimidin-5-yl)ethan-1-ol
• CAS No.: 79691-74-0
• Molecular Formula: C6H8 N2 O
• Molecular Weight: 124.142
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID90507457
• Mol file: 79691-74-0.mol

Synonyms:1-(Pyrimidin-5-yl)ethan-1-ol;79691-74-0;1-(Pyrimidin-5-yl)ethanol;1-pyrimidin-5-ylethanol;1-PYRIMIDIN-5-YL-ETHANOL;ALPHA-METHYL-5-PYRIMIDINEMETHANOL;|A-Methyl-5-pyrimidinemethanol;SCHEMBL6980862;DTXSID90507457;MFCD16779027;AKOS011779597;SB15649;AS-51115;CS-0054425;FT-0672193;FT-0772277;EN300-159712;P11936

Chemical Property of 1-(Pyrimidin-5-yl)ethan-1-ol

Chemical Property:

• PSA: 46.01000
• LogP: 0.52990
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 124.063662883
• Heavy Atom Count: 9
• Complexity: 81.1

Purity/Quality:

NLT 98% ^*data from raw suppliers

α-Methyl-5-pyrimidinemethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CN=CN=C1)O
• Uses: As a pyrimidine derivative, α-Methyl-5-pyriMidineMethanol can be used in the preparation of muscarinic agonist for treatment of Alzheimer's disease. A pyrimidine derivative used in the preparation of muscarinic agonist for treatment of Alzheimer''s disease.

Technology Process of 1-(Pyrimidin-5-yl)ethan-1-ol

There total 3 articles about 1-(Pyrimidin-5-yl)ethan-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: 79.0%

4,6-dichloro-5-(α-hydroxyethyl)pyrimidine (60025-05-0) → 5-(α-hydroxyethyl)pyrimidine (79691-74-0)

Guidance literature:

With hydrogen; magnesium oxide; palladium on activated charcoal; In ethanol; for 12h; Heating;

DOI:10.1007/BF00506042

Reference yield: 70.0%

methylmagnesium bromide (75-16-1) + pyrimidine-5-carbaldehyde (10070-92-5) → 5-(α-hydroxyethyl)pyrimidine (79691-74-0)

Guidance literature:

In tetrahydrofuran; at -70 ℃; for 1h;

Reference yield: 61.0%

→ 5-(α-hydroxyethyl)pyrimidine (79691-74-0)

Guidance literature:

upstream raw materials:

4,6-dichloro-5-(α-hydroxyethyl)pyrimidine

methylmagnesium bromide

pyrimidine-5-carbaldehyde

Downstream raw materials:

pyrimidin-5-amine

1-(pyrimidin-5-yl)ethan-1-one

Refernces

• 1、 Jung, Myung Hee,Park, Jewn-Giew,Yang, Kong Jae,Lee, Mi-Jeoung. "Synthesis and muscarinic activity of 1,2,3,4-tetrahydropyrimidine derivatives". . p. 79 - 85. Retrieved 2007/10/03.
• 2、 Naumenko, I. I.,Mikhaleva, M. A.,Mamaev, V. P.. "PYRIMIDINES. 73. SYNTHESIS OF ACETYLPYRIMIDINES". . p. 710 - 714. Retrieved 2007/10/02.