1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)-

Base Information

• Chemical Name: 1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)-
• CAS No.: 143759-58-4
• Molecular Formula: C26H31 N3 O
• Molecular Weight: 401.54
• DSSTox Substance ID: DTXSID50932009
• Mol file: 143759-58-4.mol

Synonyms:143759-58-4;1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)-;1-anilino-3-(4-benzhydrylpiperazin-1-yl)propan-2-ol;1-Diphenylmethyl-4-(2-hydroxy-3-phenylaminopropyl)-piperazine;4-(Diphenylmethyl)-alpha-((phenylamino)methyl)-1-piperazineethanol;SCHEMBL8616272;DTXSID50932009;LS-112345;1-Anilino-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol;1-Diphenylmethyl-4- (2-hydroxy-3-phenylaminopropyl)-piperazine

Chemical Property of 1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)-

Chemical Property:

• Vapor Pressure: 7.17E-15mmHg at 25°C
• Melting Point: 132-135 °C
• Boiling Point: 592.2°Cat760mmHg
• PKA: 14.17±0.20(Predicted)
• Flash Point: 312°C
• PSA: 38.74000
• Density: 1.158g/cm³
• LogP: 3.81540
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 401.246712621
• Heavy Atom Count: 30
• Complexity: 443

Purity/Quality:

1-PIPERAZINEETHANOL, 4-(DIPHENYLMETHYL)-ALPHA-((PHENYLAMINO)METHYL)- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CC(CNC2=CC=CC=C2)O)C(C3=CC=CC=C3)C4=CC=CC=C4

Technology Process of 1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)-

There total 2 articles about 1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)- 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: 88.0%

N-(2-oxiranylmethyl)aniline (10525-86-7) + diphenylmethylpiperazine (841-77-0) → 1-(4-benzhydrylpiperazin-1-yl)-3-phenylaminopropan-2-ol (143759-58-4)

Guidance literature:

N-(2-oxiranylmethyl)aniline; diphenylmethylpiperazine; With aluminium(III) triflate; In toluene; at 70 ℃; for 5h;

With sodium hydrogencarbonate; In water; toluene; regioselective reaction;

DOI:10.1021/jo9020437

Reference yield:

1-(diphenylmethyl)-4-(2,3-epoxypropyl)piperazine (111452-72-3) → 1-(4-benzhydrylpiperazin-1-yl)-3-phenylaminopropan-2-ol (143759-58-4)

Guidance literature:

With aniline; In N,N-dimethyl-formamide;

upstream raw materials:

1-(diphenylmethyl)-4-(2,3-epoxypropyl)piperazine

N-(2-oxiranylmethyl)aniline

diphenylmethylpiperazine