4-Hydroxy-N-phenyl-3,5-bis(1-pyrrolidinylmethyl)benzamide

Base Information

• Chemical Name: 4-Hydroxy-N-phenyl-3,5-bis(1-pyrrolidinylmethyl)benzamide
• CAS No.: 90446-66-5
• Molecular Formula: C₂₃H₂₉N₃O₂
• Molecular Weight: 379.502
• UNII: 25576739PX
• DSSTox Substance ID: DTXSID50238174
• Nikkaji Number: J20.576A
• Wikidata: Q27253911
• ChEMBL ID: CHEMBL58583
• Mol file: 90446-66-5.mol

Synonyms:4-hydroxy-N-phenyl-3,5-bis(1-pyrrolidinylmethyl)benzamide;ACC 9358;ACC-9358;DuP 923;DuP-923;N-((3,5-di-(pyrrolidinylmethyl)-4-hydroxy)benzoyl)aniline

Chemical Property of 4-Hydroxy-N-phenyl-3,5-bis(1-pyrrolidinylmethyl)benzamide

Chemical Property:

• Vapor Pressure: 2.14E-10mmHg at 25°C
• Boiling Point: 494.3°Cat760mmHg
• Flash Point: 252.8°C
• Density: 1.248g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 379.22597718
• Heavy Atom Count: 28
• Complexity: 468

Purity/Quality:

More than 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)CC2=CC(=CC(=C2O)CN3CCCC3)C(=O)NC4=CC=CC=C4

Technology Process of 4-Hydroxy-N-phenyl-3,5-bis(1-pyrrolidinylmethyl)benzamide

There total 4 articles about 4-Hydroxy-N-phenyl-3,5-bis(1-pyrrolidinylmethyl)benzamide 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:

pyrrolidine (123-75-1) + 4-hydroxybenzanilide (14121-97-2) → 2,6-bis(1-pyrrolidinylmethyl)-4-benzamidophenol (90446-66-5)

Guidance literature:

In ethanol;

Reference yield:

aniline (62-53-3) → 2,6-bis(1-pyrrolidinylmethyl)-4-benzamidophenol (90446-66-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 23 percent / P₂O₅ / toluene / 3 h / Heating

2: ethanol; H₂O / 6 h / Heating

With phosphorus pentoxide; In ethanol; water; toluene;

DOI:10.1021/jm00381a003

Reference yield:

4-hydroxy-benzoic acid (99-96-7) → 2,6-bis(1-pyrrolidinylmethyl)-4-benzamidophenol (90446-66-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 23 percent / P₂O₅ / toluene / 3 h / Heating

2: ethanol; H₂O / 6 h / Heating

With phosphorus pentoxide; In ethanol; water; toluene;

DOI:10.1021/jm00381a003

upstream raw materials:

pyrrolidine

formaldehyd

4-hydroxybenzanilide

aniline