4-(3-Pyridyl)-1-butanol

Base Information

• Chemical Name: 4-(3-Pyridyl)-1-butanol
• CAS No.: 60753-14-2
• Molecular Formula: C9H13NO
• Molecular Weight: 151.208
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID60879577
• Nikkaji Number: J1.607.833F
• Wikidata: Q82861687
• Mol file: 60753-14-2.mol

Synonyms:60753-14-2;4-(3-Pyridyl)-1-butanol;4-(Pyridin-3-yl)butan-1-ol;3-Pyridinebutanol;4-pyridin-3-ylbutan-1-ol;MFCD18802565;3-(4-hydroxybutyl)-pyridine;4-(3-pyridyl)but-Anol;3-(4-hydroxybutyl)pyridine;SCHEMBL1288240;AMY9009;DTXSID60879577;GPJCBIYBTLQPQG-UHFFFAOYSA-N;AKOS022186963;DS-8635;SB52683;SY022160;CS-0158352;A868894

Chemical Property of 4-(3-Pyridyl)-1-butanol

Chemical Property:

• PSA: 33.12000
• LogP: 1.39660
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 151.099714038
• Heavy Atom Count: 11
• Complexity: 95.6

Purity/Quality:

97% ^*data from raw suppliers

4-(3-Pyridyl)-1-butanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CN=C1)CCCCO

Technology Process of 4-(3-Pyridyl)-1-butanol

There total 10 articles about 4-(3-Pyridyl)-1-butanol 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: 99.0%

4-(pyridin-3-yl)-1-but-3-ynol (138487-20-4) → 3-(4-hydroxybutyl)-pyridine (60753-14-2)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; at 20 ℃;

DOI:10.1021/acs.jmedchem.7b00098

Reference yield: 85.0%

ethyl 4-(pyridin-3-yl)butanoate (60753-13-1) → 3-(4-hydroxybutyl)-pyridine (60753-14-2)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether;

DOI:10.1002/hlca.19820650621

Reference yield: 81.0%

4-(3-pyridyl)butyl tert-butyldimethylsilyl ether (174523-91-2) → 3-(4-hydroxybutyl)-pyridine (60753-14-2)

Guidance literature:

With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 20 ℃; for 1h;

DOI:10.1021/ol0166909

upstream raw materials:

ethyl 4-(pyridin-3-yl)butanoate

4-(3-pyridyl)but-3-en-1-ol

4-(pyridin-3-yl)-1-but-3-ynol

4-(3-pyridyl)butyl tert-butyldimethylsilyl ether

Downstream raw materials:

3-(4-Chloro-benzoyl)-5-fluoro-1-(4-pyridin-3-yl-butyl)-1H-indole-2-carboxylic acid ethyl ester

4-(3-pyridyl)butyl phenylpropynoate

4-(3-pyridinyl)butyraldehyde

N-Boc-pipecolic acid 1-phenyl-7-(3'-pyridyl)heptan-4-ol ester