N-Methyl-2,3-difluorobenzylamine

Base Information

• Chemical Name: N-Methyl-2,3-difluorobenzylamine
• CAS No.: 906645-41-8
• Molecular Formula: C₈H₉F₂N
• Molecular Weight: 157.163
• Hs Code.: 2921499090
• European Community (EC) Number: 835-376-2
• DSSTox Substance ID: DTXSID30655749
• Wikidata: Q82570003
• Mol file: 906645-41-8.mol

Synonyms:N-Methyl-2,3-difluorobenzylamine;906645-41-8;1-(2,3-Difluorophenyl)-N-methylmethanamine;N-(2,3-Difluorobenzyl)-N-methylamine;MFCD12147620;SCHEMBL3482873;DTXSID30655749;AC1201;AKOS009118600;CS-11288;SY014375;[(2,3-difluorophenyl)methyl](methyl)amine;FT-0748068;EN300-164086;A860736

Chemical Property of N-Methyl-2,3-difluorobenzylamine

Chemical Property:

• PSA: 12.03000
• LogP: 2.07510
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 157.07030562
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

97% ^*data from raw suppliers

N-Methyl-2,3-difluorobenzylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNCC1=C(C(=CC=C1)F)F

Technology Process of N-Methyl-2,3-difluorobenzylamine

There total 1 articles about N-Methyl-2,3-difluorobenzylamine 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:

2,3-difluorobenzaldehyde (2646-91-5) + methylamine hydrochloride (593-51-1) → C8H9F2N (906645-41-8)

Guidance literature:

methylamine hydrochloride; With potassium carbonate; In methanol; at 20 ℃; for 0.5h;

2,3-difluorobenzaldehyde; In methanol; at 20 ℃; for 1h;

With methanol; sodium tetrahydroborate; at 0 - 20 ℃; for 3h;

DOI:10.1021/acs.jmedchem.6b01196

Reference yield:

C8H9F2N (906645-41-8) + C26H35FN2O7 (906645-36-1) → C34H42F3N3O6 (957112-82-2)

Guidance literature:

With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In dichloromethane; at 20 ℃; for 18h;

DOI:10.1016/j.bmcl.2007.08.004

Reference yield:

C8H9F2N (906645-41-8) + 2,2-dimethylbutanoyl chloride (5856-77-9) → N-(2,3-difluorobenzyl)-N,2,2-trimethylbutanamide

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; at 0 - 20 ℃; for 2h; Inert atmosphere;

DOI:10.1021/acs.jmedchem.6b01196

upstream raw materials:

2,3-difluorobenzaldehyde

methylamine hydrochloride

Downstream raw materials:

C₃₄H₄₂F₃N₃O₆