3-[4-(3-Methylphenyl)piperazin-1-yl]propan-1-ol

Base Information

• Chemical Name: 3-[4-(3-Methylphenyl)piperazin-1-yl]propan-1-ol
• CAS No.: 7511-73-1
• Molecular Formula: C14H22N2O
• Molecular Weight: 234.341
• NSC Number: 33320
• DSSTox Substance ID: DTXSID70283762
• Wikidata: Q82018447

Synonyms:3-[4-(3-methylphenyl)piperazin-1-yl]propan-1-ol;7511-73-1;NSC33320;SCHEMBL11161100;DTXSID70283762;NSC-33320;AKOS005832722

Chemical Property of 3-[4-(3-Methylphenyl)piperazin-1-yl]propan-1-ol

Chemical Property:

• Vapor Pressure: 5.97E-07mmHg at 25°C
• Boiling Point: 395.1°Cat760mmHg
• Flash Point: 199.7°C
• Density: 1.062g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 234.173213330
• Heavy Atom Count: 17
• Complexity: 214

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)N2CCN(CC2)CCCO

Technology Process of 3-[4-(3-Methylphenyl)piperazin-1-yl]propan-1-ol

There total 1 articles about 3-[4-(3-Methylphenyl)piperazin-1-yl]propan-1-ol 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: 90.0%

3-(4-m-tolyl-piperazino)-propionic acid ethyl ester (80428-88-2) → 1-(3-hydroxy-n-propyl)-4-(3-methylphenyl)piperazine (7511-73-1)

Guidance literature:

In tetrahydrofuran;

Reference yield: 85.0%

1-(3-hydroxy-n-propyl)-4-(3-methylphenyl)piperazine (7511-73-1) + p-toluenesulfonyl chloride (98-59-9) → 1-(2-chloropropyl)-4-(3-methylphenyl)piperazine (6320-26-9)

Guidance literature:

With triethylamine; In methanol; dichloromethane;

Reference yield: 79.0%

1-(3-hydroxy-n-propyl)-4-(3-methylphenyl)piperazine (7511-73-1) → 1-(2-chloropropyl)-4-(3-methylphenyl)piperazine (6320-26-9)

Guidance literature:

With triphenylphosphine; In tetrachloromethane; Heating;

DOI:10.1248/cpb.35.2394

upstream raw materials:

3-(4-m-tolyl-piperazino)-propionic acid ethyl ester

Downstream raw materials:

1-(2-chloropropyl)-4-(3-methylphenyl)piperazine

2-[3-(4-m-Tolyl-piperazin-1-yl)-propoxy]-benzaldehyde

2-{2-[3-(4-m-Tolyl-piperazin-1-yl)-propoxy]-phenyl}-thiazolidine-3-carbothioic acid methylamide

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