Cyclohexylmethyl 2-pyridyl ketone

Base Information

• Chemical Name: Cyclohexylmethyl 2-pyridyl ketone
• CAS No.: 149108-75-8
• Molecular Formula: C13H17NO
• Molecular Weight: 203.284
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID60453851
• Wikidata: Q82275116
• Mol file: 149108-75-8.mol

Synonyms:CYCLOHEXYLMETHYL 2-PYRIDYL KETONE;149108-75-8;2-cyclohexyl-1-pyridin-2-ylethanone;MFCD07699209;SCHEMBL7759502;DTXSID60453851;CYCLOHEXYLMETHYL2-PYRIDYLKETONE;AKOS011915112

Chemical Property of Cyclohexylmethyl 2-pyridyl ketone

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 318.043oC at 760 mmHg
• Flash Point: 154.151oC
• PSA: 29.96000
• Density: 1.034g/cm3
• LogP: 3.23470
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 203.131014166
• Heavy Atom Count: 15
• Complexity: 209

Purity/Quality:

97% ^*data from raw suppliers

Cyclohexylmethyl2-pyridylketone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)CC(=O)C2=CC=CC=N2

Technology Process of Cyclohexylmethyl 2-pyridyl ketone

There total 10 articles about Cyclohexylmethyl 2-pyridyl ketone 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: 89.0%

2-cyclohexyl-1-(2-pyridyl)ethanol (155392-46-4) → 2-cyclohexyl-1-(pyridin-2-yl)ethan-1-one (149108-75-8)

Guidance literature:

With manganese(IV) oxide; In dichloromethane; Ambient temperature;

DOI:10.1021/jm00033a008

Reference yield: 87.0%

→ pyridylcyclohexylmethylketone + 2-cyclohexyl-1-(pyridin-2-yl)ethan-1-one (149108-75-8)

Guidance literature:

Reference yield: 72.0%

2-pyridyllithium (17624-36-1) + 2-cyclohexyl-N-methoxy-N-methylacetamide (134560-43-3) → 2-cyclohexyl-1-(pyridin-2-yl)ethan-1-one (149108-75-8)

Guidance literature:

In tetrahydrofuran; at -78 - 20 ℃; for 2h;

DOI:10.1016/j.bmcl.2006.07.074

upstream raw materials:

2-bromo-pyridine

2-cyclohexyl-N-methoxy-N-methylacetamide

2-cyclohexyl-1-(2-pyridyl)ethanol

2-pyridyllithium

Downstream raw materials:

(R)-2-((S)-2-Cyclohexyl-1-pyridin-2-yl-ethylamino)-2-phenyl-ethanol

1-(S,R)-(pyridin-2-yl)-2-cyclohexylethylamine

4-cyclohexyl-5-pyridin-2-yl-1H-pyrrole-2-carbaldehyde

2-(3-cyclohexyl-1H-pyrrol-2-yl)-pyridine