2-(5-Bromopyridin-2-YL)ethanol

Base Information

• Chemical Name: 2-(5-Bromopyridin-2-YL)ethanol
• CAS No.: 1206968-77-5
• Molecular Formula: C7H8BrNO
• Molecular Weight: 202
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID50695223
• Wikidata: Q82624338
• Mol file: 1206968-77-5.mol

Synonyms:2-(5-BROMOPYRIDIN-2-YL)ETHANOL;1206968-77-5;5-BROMOPYRIDINE-2-ETHANOL;2-(5-BROMOPYRIDIN-2-YL)ETHAN-1-OL;MFCD09999981;SCHEMBL5650;DTXSID50695223;RXFPLSUXRPOSOF-UHFFFAOYSA-N;AKOS016004291;PB14792;AS-33748;SY234050;CS-0052265;EN300-1912513;A892130

Chemical Property of 2-(5-Bromopyridin-2-YL)ethanol

Chemical Property:

• Boiling Point: 273.1±25.0 °C(Predicted)
• PKA: 14.37±0.10(Predicted)
• PSA: 33.12000
• Density: 1.564±0.06 g/cm3(Predicted)
• LogP: 1.37890
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 200.97893
• Heavy Atom Count: 10
• Complexity: 99.6

Purity/Quality:

97% ^*data from raw suppliers

2-(5-Bromopyridin-2-yl)ethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=NC=C1Br)CCO

Technology Process of 2-(5-Bromopyridin-2-YL)ethanol

There total 9 articles about 2-(5-Bromopyridin-2-YL)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: 87.0%

5-bromo-2-methylpyridine (3430-13-5) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 2-(5-bromopyridin-2-yl)ethan-1-ol (1206968-77-5)

Guidance literature:

5-bromo-2-methylpyridine; With n-butyllithium; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; pentane; at -78 ℃; for 2h;

N,N-dimethyl-formamide; In tetrahydrofuran; pentane; at -78 - 0 ℃; for 2.5h;

With methanol; sodium tetrahydroborate; In tetrahydrofuran; pentane; at 20 ℃; for 0.5h;

Reference yield: 80.0%

2-(5-bromopyridin-2-yl)acetic acid (192642-85-6) → 2-(5-bromopyridin-2-yl)ethan-1-ol (1206968-77-5)

Guidance literature:

2-(5-bromopyridin-2-yl)acetic acid; With borane-THF; In tetrahydrofuran; at 20 ℃; for 19h; Inert atmosphere;

With acetic acid; In tetrahydrofuran; water;

Reference yield:

C8H8BrN → 2-(5-bromopyridin-2-yl)ethan-1-ol (1206968-77-5)

Guidance literature:

C₈H₈BrN; With ozone; In methanol; dichloromethane; at -78 ℃;

With sodium tetrahydroborate; In methanol; dichloromethane; at 0 ℃; for 1h;

upstream raw materials:

2,5-dibromopyridine

allyltributylstanane

2-(5-bromopyridin-2-yl)acetic acid

3-bromopyridine N-oxide

Downstream raw materials:

2,2-dichloro-N-((1R,2S)-3-fluoro-1-hydroxy-1-(4-(6-(2-(methylsulfonyl)ethyl)pyridin-3-yl)phenyl)propan-2-yl)acetamide