1-Cyclopropyl-2-methoxyethanamine hydrochloride

Base Information

• Chemical Name: 1-Cyclopropyl-2-methoxyethanamine hydrochloride
• CAS No.: 1095431-18-7
• Molecular Formula: C6H14ClNO
• Molecular Weight: 151.63
• DSSTox Substance ID: DTXSID00696907
• Mol file: 1095431-18-7.mol

Synonyms:1095431-18-7;1-CYCLOPROPYL-2-METHOXYETHANAMINE HYDROCHLORIDE;1-Cyclopropyl-2-methoxyethanamine HCl;1-cyclopropyl-2-methoxyethanamine;hydrochloride;SCHEMBL1559697;AMY5685;DTXSID00696907;AKOS025286296;AC-7881;AS-77760;CS-0188014;1-cyclopropyl-2-methoxyethanaminehydrochloride;D87133;A895011;1-CYCLOPROPYL-2-METHOXYETHAN-1-AMINE HYDROCHLORIDE;1-Cyclopropyl-2-methoxyethan-1-amine--hydrogen chloride (1/1)

Chemical Property of 1-Cyclopropyl-2-methoxyethanamine hydrochloride

Chemical Property:

• PSA: 35.25000
• LogP: 1.87240
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 151.0763918
• Heavy Atom Count: 9
• Complexity: 70.9

Purity/Quality:

99.5% ^*data from raw suppliers

1-Cyclopropyl-2-methoxyethanaminehydrochloride 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCC(C1CC1)N.Cl

Technology Process of 1-Cyclopropyl-2-methoxyethanamine hydrochloride

There total 1 articles about 1-Cyclopropyl-2-methoxyethanamine hydrochloride 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: 52.0%

2-methoxyacetonitrile (1738-36-9) + cyclopropyl bromide (4333-56-6,130561-87-4) → 1-cyclopropyl-2-methoxyethanamine hydrochloride (1095431-18-7)

Guidance literature:

cyclopropyl bromide; With magnesium; In tetrahydrofuran; at 5 ℃;

2-methoxyacetonitrile; In tetrahydrofuran; at 15 ℃; Further stages;

DOI:10.1021/op1001512

Reference yield:

1-cyclopropyl-2-methoxyethanamine hydrochloride (1095431-18-7) → (S)-4-(1-cyclopropyl-2-methoxyethyl)-6-(6-(difluoromethoxy)-2,5-dimethylpyridin-3-ylamino)-5-oxo-4,5-dihydropyrazine-2-carbonitrile (1188407-45-5)

Guidance literature:

Multi-step reaction with 5 steps

1.1: potassium carbonate; potassium iodide / acetonitrile / 3 h / 50 °C

1.2: 20 °C

2.1: tetrahydrofuran; dichloromethane / 0 - 20 °C

3.1: Chiralpak AD / methanol; ethanol; n-heptane / Resolution of racemate; Simulated moving bed chromatography; Large scale reaction

4.1: sodium hexamethyldisilazane / tetrahydrofuran / 0 - 10 °C

5.1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; zinc diacetate; zinc / 1-methyl-pyrrolidin-2-one / 16 h / 95 - 100 °C / Inert atmosphere; Large scale reaction

With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; zinc diacetate; sodium hexamethyldisilazane; potassium carbonate; potassium iodide; zinc; In tetrahydrofuran; 1-methyl-pyrrolidin-2-one; methanol; ethanol; n-heptane; dichloromethane; acetonitrile;

DOI:10.1021/op1001512

upstream raw materials:

2-methoxyacetonitrile

cyclopropyl bromide

Downstream raw materials:

(S)-4-(1-cyclopropyl-2-methoxyethyl)-6-(6-(difluoromethoxy)-2,5-dimethylpyridin-3-ylamino)-5-oxo-4,5-dihydropyrazine-2-carbonitrile

Refernces