4-Fluoro-N-(4-methoxybenzyl)aniline

Base Information

• Chemical Name: 4-Fluoro-N-(4-methoxybenzyl)aniline
• CAS No.: 80143-71-1
• Molecular Formula: C14H14FNO
• Molecular Weight: 231.27
• European Community (EC) Number: 653-216-8
• DSSTox Substance ID: DTXSID301249179
• Nikkaji Number: J2.918.982J
• Mol file: 80143-71-1.mol

Synonyms:4-FLUORO-N-(4-METHOXYBENZYL)ANILINE;80143-71-1;4-fluoro-N-[(4-methoxyphenyl)methyl]aniline;Oprea1_556201;DTXSID301249179;AKOS000240762;SB80735;CS-0302813;N-(4-fluorophenyl)-4-methoxybenzenemethanamine;N-(4-FLUOROPHENYL)-4-METHOXYBENZYLAMINE;Z266481854

Chemical Property of 4-Fluoro-N-(4-methoxybenzyl)aniline

Chemical Property:

• PSA: 21.26000
• LogP: 3.51940
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 231.105942232
• Heavy Atom Count: 17
• Complexity: 208

Purity/Quality:

98%min ^*data from raw suppliers

N-(4-FLUOROPHENYL)-4-METHOXYBENZYLAMINE Aldrich ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CNC2=CC=C(C=C2)F

Technology Process of 4-Fluoro-N-(4-methoxybenzyl)aniline

There total 7 articles about 4-Fluoro-N-(4-methoxybenzyl)aniline 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: 100.0%

N-(4-methoxybenzylidene)-4-fluoroaniline (3381-48-4) → N-(4-fluorophenyl)-4-methoxybenzenemethanamine (80143-71-1)

Guidance literature:

With hydrogen; In toluene; at 100 ℃; for 0.5h; under 760.051 Torr;

DOI:10.1039/c3ra44364g

Reference yield: 98.0%

4-methoxy-benzaldehyde (123-11-5) + 4-fluoroaniline (371-40-4) → N-(4-fluorophenyl)-4-methoxybenzenemethanamine (80143-71-1)

Guidance literature:

With phenylsilane; (1-(3-methoxybenzyl)-3-methyl-1,3-dihydro-2H-benzo[d]imidazol-2-ylidene)p-cymeneruthenium(II) chloride; In ethanol; at 30 ℃; for 0.583333h; Schlenk technique; Inert atmosphere; Molecular sieve;

DOI:10.1002/ejic.202000069

Reference yield: 98.0%

(E)-N-(4-fluorophenyl)-1-(4-methoxyphenyl)methanimine (98986-85-7) → N-(4-fluorophenyl)-4-methoxybenzenemethanamine (80143-71-1)

Guidance literature:

With phenylsilane; (1-(3-methoxybenzyl)-3-methyl-1,3-dihydro-2H-benzo[d]imidazol-2-ylidene)p-cymeneruthenium(II) chloride; In ethanol; at 30 ℃; for 0.0833333h; chemoselective reaction; Inert atmosphere; Schlenk technique;

DOI:10.1002/ejic.202000069

upstream raw materials:

N-(4-methoxybenzylidene)-4-fluoroaniline

4-methoxy-benzaldehyde

4-fluoroaniline

4-Methoxybenzyl alcohol

Downstream raw materials:

C₁₇H₁₈FNO

N-(4-Fluoro-phenyl)-N-(4-methoxy-benzyl)-benzenesulfonamide

Refernces

• 1、 Xi, Zi-Wei,Yang, Lei,Wang, Dan-Yan,Pu, Chao-Dan,Shen, Yong-Miao,Wu, Chuan-De,Peng, Xiao-Gang. "Visible-Light Photocatalytic Synthesis of Amines from Imines via Transfer Hydrogenation Using Quantum Dots as Catalysts". . p. 11886 - 11895. Retrieved 2018/09/25.
• 2、 Hernández-Juárez, Martín,López-Serrano, Joaquín,Lara, Patricia,Morales-Cerón, Judith P.,Vaquero, Mónica,álvarez, Eleuterio,Salazar, Verónica,Suárez, Andrés. "Ruthenium(II) complexes containing lutidine-derived pincer CNC ligands: Synthesis, structure, and catalytic hydrogenation of C=N bonds". . p. 7540 - 7555. Retrieved 2015/05/13.