1-(3-Fluorophenyl)cyclopropanemethanamine

Base Information

• Chemical Name: 1-(3-Fluorophenyl)cyclopropanemethanamine
• CAS No.: 886365-90-8
• Molecular Formula: C10H12FN
• Molecular Weight: 165.21
• European Community (EC) Number: 840-949-5
• DSSTox Substance ID: DTXSID801271030
• Mol file: 886365-90-8.mol

Synonyms:886365-90-8;1-(3-Fluorophenyl)cyclopropanemethanamine;(1-(3-Fluorophenyl)cyclopropyl)methanamine;[1-(3-fluorophenyl)cyclopropyl]methanamine;C-[1-(3-FLUORO-PHENYL)-CYCLOPROPYL]-METHYLAMINE;1-[1-(3-FLUOROPHENYL)CYCLOPROPYL]METHANAMINE;SCHEMBL3223371;DTXSID801271030;AC7100;MFCD07374429;AKOS000345289;AB39441;BS-53236;SY196854;DB-078054;EN300-83292;A915385;Z361883914

Chemical Property of 1-(3-Fluorophenyl)cyclopropanemethanamine

Chemical Property:

• PSA: 26.02000
• LogP: 2.51630
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 165.095377549
• Heavy Atom Count: 12
• Complexity: 165

Purity/Quality:

97% ^*data from raw suppliers

C-[1-(3-Fluoro-phenyl)-cyclopropyl]-methylamine >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1(CN)C2=CC(=CC=C2)F

Technology Process of 1-(3-Fluorophenyl)cyclopropanemethanamine

There total 2 articles about 1-(3-Fluorophenyl)cyclopropanemethanamine 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:

1-(3-fluorophenyl)cyclopropane-1-carbonitrile (124276-55-7) → 1-(3-fluorophenyl)cyclopropyl methylamine (886365-90-8)

Guidance literature:

1-(3-fluorophenyl)cyclopropane carbonitrile; With lithium aluminium tetrahydride; In tetrahydrofuran; diethyl ether; at 0 ℃; for 3h;

With water; In tetrahydrofuran; diethyl ether;

Reference yield:

3-fluorophenylacetonitrile (501-00-8) → 1-(3-fluorophenyl)cyclopropyl methylamine (886365-90-8)

Guidance literature:

Multi-step reaction with 2 steps

1.1: sodium hydride / dimethyl sulfoxide / 0.5 h / 20 °C

1.2: 5 h

2.1: lithium aluminium tetrahydride / tetrahydrofuran; diethyl ether / 3 h / 0 °C

With lithium aluminium tetrahydride; sodium hydride; In tetrahydrofuran; diethyl ether; dimethyl sulfoxide;

Reference yield:

1-(3-fluorophenyl)cyclopropyl methylamine (886365-90-8) + C12H9ClN2O5 (1039455-20-3) → C22H20FN3O5 (1039454-25-5)

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃; for 2h;

upstream raw materials:

1-(3-fluorophenyl)cyclopropane-1-carbonitrile

3-fluorophenylacetonitrile

Downstream raw materials:

C₂₂H₂₀FN₃O₅

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