4-(2-PHENYLETHYL)ANILINE

Base Information

• Chemical Name: 4-(2-PHENYLETHYL)ANILINE
• CAS No.: 13024-49-2
• Molecular Formula: C14H15 N
• Molecular Weight: 197.28
• Hs Code.: 2921420090
• NSC Number: 210538
• UNII: 631H8Q18TR
• DSSTox Substance ID: DTXSID5036840
• Nikkaji Number: J81.531D
• Wikidata: Q27894107
• ChEMBL ID: CHEMBL1739048
• Mol file: 13024-49-2.mol

Synonyms:Aniline,p-phenethyl- (6CI,7CI,8CI); 1-(4-Aminophenyl)-2-phenylethane; 4-Aminodibenzyl;NSC 210538; p-Phenethylaniline

Chemical Property of 4-(2-PHENYLETHYL)ANILINE

Chemical Property:

• Vapor Pressure: 0.000324mmHg at 25°C
• Melting Point: 52-54 °C(Solv: ligroine (8032-32-4))
• Boiling Point: 320.1°Cat760mmHg
• PKA: 4.90±0.10(Predicted)
• Flash Point: 153.9°C
• PSA: 26.02000
• Density: 1.065g/cm³
• LogP: 3.63520
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 197.120449483
• Heavy Atom Count: 15
• Complexity: 164

Purity/Quality:

97% ^*data from raw suppliers

Benzenamine,4-(2-phenylethyl)- 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CCC2=CC=C(C=C2)N

Technology Process of 4-(2-PHENYLETHYL)ANILINE

There total 24 articles about 4-(2-PHENYLETHYL)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%

4-phenylethynylphenylamine (1849-25-8) → 4-aminodibenzyl (13024-49-2)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; at 20 ℃;

DOI:10.1021/acs.joc.9b03202

Reference yield: 99.0%

4-nitrostilbene (1694-20-8,4003-94-5,6624-53-9,101977-34-8) → 4-aminodibenzyl (13024-49-2)

Guidance literature:

With hydrogen; 10percent Pd/C; In methanol;

DOI:10.1021/jm010261z

Reference yield: 98.0%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + para-nitrophenyl bromide (586-78-7) → 4-aminodibenzyl (13024-49-2)

Guidance literature:

styrene; para-nitrophenyl bromide; With sodium acetate; In N,N-dimethyl acetamide; at 100 ℃; Inert atmosphere;

With hydrogen; In N,N-dimethyl acetamide; at 20 ℃; under 760.051 Torr;

DOI:10.1002/adsc.200800460

upstream raw materials:

trans-4-nitrostilbene

1-nitro-4-phenethylbenzene

N-bibenzyl-4-yl-acetamide

N-bibenzyl-4-yl-benzamide

Downstream raw materials:

4-phenethylbenzoic acid

4-(2-phenylethyl)phenol

N-bibenzyl-4-yl-acetamide

N-(2-morpholin-4-yl-ethyl)-4-phenethyl-aniline