Methyl picolinimidate

Base Information

• Chemical Name: Methyl picolinimidate
• CAS No.: 19547-38-7
• Molecular Formula: C7H8N2O
• Molecular Weight: 136.153
• Hs Code.: 2933399090
• European Community (EC) Number: 803-342-6
• DSSTox Substance ID: DTXSID70941315
• Nikkaji Number: J1.102.397E
• Wikidata: Q82918108
• Mol file: 19547-38-7.mol

Synonyms:methyl picolinimidate

Chemical Property of Methyl picolinimidate

Chemical Property:

• Vapor Pressure: 0.617mmHg at 25°C
• Refractive Index: 1.534
• Boiling Point: 194.459 °C at 760 mmHg
• PKA: 4.73±0.70(Predicted)
• Flash Point: 71.407 °C
• PSA: 45.97000
• Density: 1.101 g/cm³
• LogP: 1.15310
• Storage Temp.: Store at -20
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 136.063662883
• Heavy Atom Count: 10
• Complexity: 125

Purity/Quality:

98%,99%, ^*data from raw suppliers

PicolinimidicAcidMethylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=N)C1=CC=CC=N1
• Uses: An imidoesters An imidoesters with effect on ion transport in human erythrocytes.

Technology Process of Methyl picolinimidate

There total 7 articles about Methyl picolinimidate 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%

2-Cyanopyridine (100-70-9,1232006-36-8) + methanol (67-56-1) → methyl pyridine-2-imidate (19547-38-7)

Guidance literature:

With sodium hydroxide; for 0.333333h; Ambient temperature;

DOI:10.1002/jhet.5570360101

Reference yield: 78.0%

2-Cyanopyridine (100-70-9,1232006-36-8) + sodium methylate (124-41-4) → methyl pyridine-2-imidate (19547-38-7)

Guidance literature:

In methanol; at 20 - 22 ℃; for 15h;

DOI:10.1002/anie.200503941

Reference yield:

2-Cyanopyridine (100-70-9,1232006-36-8) + methanol (67-56-1) → methyl pyridine-2-carboxylate (2459-07-6,260998-83-2) + methyl pyridine-2-imidate (19547-38-7) + methyl carbamate (598-55-0)

Guidance literature:

With cerium(IV) oxide; carbon dioxide; at 119.84 ℃; for 24h; under 750.075 - 7500.75 Torr; Autoclave;

DOI:10.1016/j.jcat.2014.07.022

upstream raw materials:

2-Cyanopyridine

methanol

sodium methylate

pyridine-2-carbaldehyde

Downstream raw materials:

2-[(4S)-4-iso-propyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine

(S)-(-)-4-(2-Methylpropyl)-2-(2-pyridinyl)-2-oxazolin

(4S,5R)-(+)-4-Methyl-5-phenyl-2-(2-pyridinyl)-2-oxazolin

2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine