(4-(p-Tolyloxy)phenyl)methanamine

Base Information

• Chemical Name: (4-(p-Tolyloxy)phenyl)methanamine
• CAS No.: 129560-03-8
• Molecular Formula: C14H15 N O
• Molecular Weight: 213.279
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID80360255
• Nikkaji Number: J1.648.080K
• Wikidata: Q82141898
• Mol file: 129560-03-8.mol

Synonyms:(4-(p-Tolyloxy)phenyl)methanamine;129560-03-8;[4-(4-methylphenoxy)phenyl]methanamine;4-p-Tolyloxy-benzylamine;Benzenemethanamine, 4-(4-methylphenoxy)-;4-(4-METHYLPHENOXY)-BENZENEMETHANAMINE;4-(p-Tolyloxy)benzylamine;SCHEMBL920927;4-(4-methylphenoxy)benzylamine;4-(4-methylphenyloxy)benzylamine;DTXSID80360255;4-(4-Methylphenoxy)benzenemethanamine;AKOS000218320;SB77128;CS-0370579;E87687;1-[4-(4-METHYLPHENOXY)PHENYL]METHANAMINE;A805951;J-016364;BRD-K10318280-001-01-8

Chemical Property of (4-(p-Tolyloxy)phenyl)methanamine

Chemical Property:

• PSA: 35.25000
• LogP: 3.94630
• Storage Temp.: 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 213.115364102
• Heavy Atom Count: 16
• Complexity: 191

Purity/Quality:

97% ^*data from raw suppliers

(4-(p-Tolyloxy)phenyl)methanamine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)OC2=CC=C(C=C2)CN

Technology Process of (4-(p-Tolyloxy)phenyl)methanamine

There total 5 articles about (4-(p-Tolyloxy)phenyl)methanamine 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: 96.1%

4-(4'-methylphenoxy)benzonitrile (37563-42-1) → (4‐(p‐tolyloxy)phenyl)methanamine (129560-03-8)

Guidance literature:

With ammonia; hydrogen; In methanol; at 55 ℃; for 3h; under 26252.6 Torr; Reagent/catalyst; Solvent; Inert atmosphere; Large scale;

Reference yield:

p-cresol (106-44-5) → (4‐(p‐tolyloxy)phenyl)methanamine (129560-03-8)

Guidance literature:

Multi-step reaction with 2 steps

1: N,N-dimethyl-formamide / 2 h / 100 °C / Alkaline conditions

2: lithium aluminium tetrahydride / tetrahydrofuran / 3 h / 0 - 20 °C / Inert atmosphere

With lithium aluminium tetrahydride; In tetrahydrofuran; N,N-dimethyl-formamide;

DOI:10.1021/acs.jmedchem.8b01789

Reference yield:

4-fluorobenzonitrile (1194-02-1,143234-87-1) → (4‐(p‐tolyloxy)phenyl)methanamine (129560-03-8)

Guidance literature:

Multi-step reaction with 2 steps

1: N,N-dimethyl-formamide / 2 h / 100 °C / Alkaline conditions

2: lithium aluminium tetrahydride / tetrahydrofuran / 3 h / 0 - 20 °C / Inert atmosphere

With lithium aluminium tetrahydride; In tetrahydrofuran; N,N-dimethyl-formamide;

DOI:10.1021/acs.jmedchem.8b01789

upstream raw materials:

4-(4'-methylphenoxy)benzonitrile

p-cresol

4-fluorobenzonitrile

potassium p-cresolate

Downstream raw materials:

N-[4-(4-methylphenyloxy)phenyl]methyl-2-aminonicotinic acid amide

N-[4-(4-methylphenyloxy)phenyl]methyl-2-amino-6-methylnicotinic acid amide