4-Methoxycarbonyl-bicyclo[2.2.2]oct-1-YL ammonium chloride

Base Information

• Chemical Name: 4-Methoxycarbonyl-bicyclo[2.2.2]oct-1-YL ammonium chloride
• CAS No.: 135908-43-9
• Molecular Formula: C10H18ClNO2
• Molecular Weight: 219.711
• Hs Code.: 2922499990
• Mol file: 135908-43-9.mol

Synonyms:4-METHOXYCARBONYL-BICYCLO[2.2.2]OCT-1-YL AMMONIUM CHLORIDE;4-(methoxycarbonyl)bicyclo[2.2.2]octan-1-aminium chloride;AMY15702;AKOS028110078;4-(Methoxycarbonyl)bicyclo-[2.2.2]octan-1-aminium chloride

Chemical Property of 4-Methoxycarbonyl-bicyclo[2.2.2]oct-1-YL ammonium chloride

Chemical Property:

• PSA: 52.32000
• LogP: 2.71340
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 219.1026065
• Heavy Atom Count: 14
• Complexity: 213

Purity/Quality:

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

Methyl4-Aminobicyclo[2.2.2]octane-1-carboxylateHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C12CCC(CC1)(CC2)[NH3+].[Cl-]

Technology Process of 4-Methoxycarbonyl-bicyclo[2.2.2]oct-1-YL ammonium chloride

There total 1 articles about 4-Methoxycarbonyl-bicyclo[2.2.2]oct-1-YL ammonium chloride 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:

→ methyl 4-aminobicyclo[2.2.2]octane-1-carboxylate hydrochloride (135908-43-9)

Guidance literature:

Reference yield: 88.0%

methyl 4-aminobicyclo[2.2.2]octane-1-carboxylate hydrochloride (135908-43-9) + 2-(4-chloro-3-fluorophenoxy)acetic acid (331-41-9) → methyl 4-[2-(4-chloro-3-fluorophenoxy)acetamido]bicyclo[2.2.2]octane-1-carboxylate

Guidance literature:

With (1-cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 1h;

Reference yield: 17.0%

methyl 4-aminobicyclo[2.2.2]octane-1-carboxylate hydrochloride (135908-43-9) + 1-(4-chloro-2-fluorobenzyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine hydrochloride + 1,1'-carbonyldiimidazole (530-62-1) → methyl 4-(1-(4-chloro-2-fluorobenzyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-6-carboxamido)bicyclo[2.2.2]octane-1-carboxylate

Guidance literature:

methyl 4-aminobicyclo[2.2.2]octane-1-carboxylate hydrochloride; 1,1'-carbonyldiimidazole; With N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In dichloromethane; at 40 ℃; for 5h;

1-(4-chloro-2-fluorobenzyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine hydrochloride; In dichloromethane; at 40 ℃; for 12h;

Refernces