[2-(Dimethylaminomethyl)cyclohexyl] 5-nitrofuran-2-carboxylate

Base Information

• Chemical Name: [2-(Dimethylaminomethyl)cyclohexyl] 5-nitrofuran-2-carboxylate
• CAS No.: 6543-37-9
• Molecular Formula: C₁₉H₁₉NO₂
• Molecular Weight: 293.365
• DSSTox Substance ID: DTXSID90412310

Synonyms:6543-37-9;[2-(dimethylaminomethyl)cyclohexyl] 5-nitrofuran-2-carboxylate;Oprea1_153156;DTXSID90412310

Chemical Property of [2-(Dimethylaminomethyl)cyclohexyl] 5-nitrofuran-2-carboxylate

Chemical Property:

• Vapor Pressure: 6.18E-07mmHg at 25°C
• Boiling Point: 410.1°Cat760mmHg
• Flash Point: 201.8°C
• Density: 1.23g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 296.13722174
• Heavy Atom Count: 21
• Complexity: 382

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1CCCCC1OC(=O)C2=CC=C(O2)[N+](=O)[O-]

Technology Process of [2-(Dimethylaminomethyl)cyclohexyl] 5-nitrofuran-2-carboxylate

There total 1 articles about [2-(Dimethylaminomethyl)cyclohexyl] 5-nitrofuran-2-carboxylate 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:

5-iodomethyl-5-methyl-2,2-diphenyl-[1,3]dioxane (874002-85-4) + sodium cyanide (143-33-9,25596-52-5) → (5-methyl-2,2-diphenyl-[1,3]dioxan-5-yl)-acetonitrile (6543-37-9)

Guidance literature:

With ethanol;

DOI:10.1021/ja01641a011

Reference yield:

(5-methyl-2,2-diphenyl-[1,3]dioxan-5-yl)-acetonitrile (6543-37-9) → 2-(5-methyl-2,2-diphenyl-[1,3]dioxan-5-yl)-ethylamine (5963-54-2)

Guidance literature:

With lithium aluminium tetrahydride; diethyl ether;

DOI:10.1021/ja01641a011

Reference yield:

(5-methyl-2,2-diphenyl-[1,3]dioxan-5-yl)-acetonitrile (6543-37-9) → (5-methyl-2,2-diphenyl-[1,3]dioxan-5-yl)-acetic acid amide

Guidance literature:

With potassium hydroxide;

DOI:10.1021/ja01641a011

upstream raw materials:

5-iodomethyl-5-methyl-2,2-diphenyl-[1,3]dioxane

sodium cyanide

Downstream raw materials:

2-(5-methyl-2,2-diphenyl-[1,3]dioxan-5-yl)-ethylamine

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