1-(3-Methylphenyl)piperidine

Base Information

• Chemical Name: 1-(3-Methylphenyl)piperidine
• CAS No.: 71982-24-6
• Molecular Formula: C12H17N
• Molecular Weight: 175.274
• DSSTox Substance ID: DTXSID401309358
• Nikkaji Number: J316.499C
• Mol file: 71982-24-6.mol

Synonyms:1-(3-methylphenyl)piperidine;1-m-Tolylpiperidine;71982-24-6;5-CARBOXYVANILLICACID;1-(3-methylphenyl)-Piperidine;SCHEMBL3307690;DTXSID401309358;FT-0765612;A19096

Chemical Property of 1-(3-Methylphenyl)piperidine

Chemical Property:

• PSA: 3.24000
• LogP: 3.05030
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 175.136099547
• Heavy Atom Count: 13
• Complexity: 149

Purity/Quality:

97% ^*data from raw suppliers

1-(3-METHYLPHENYL)PIPERIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)N2CCCCC2

Technology Process of 1-(3-Methylphenyl)piperidine

There total 30 articles about 1-(3-Methylphenyl)piperidine 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: 98.0%

piperidine (110-89-4) + 1-chloro-3-methylbenzene (108-41-8) → N-(3-methylphenyl)piperidine (71982-24-6)

Guidance literature:

With potassium tert-butylate; C₃₆H₄₃Cl₂N₃OPd; In toluene; at 130 ℃; for 12h; Inert atmosphere; Schlenk technique;

DOI:10.1016/j.jorganchem.2021.121683

Reference yield: 88.0%

piperidine (110-89-4) + 3-methyl-phenol (108-39-4) → N-(3-methylphenyl)piperidine (71982-24-6)

Guidance literature:

With [(η⁵-C₅(CH₃)₄^{3,5-bis(trifluoromethyl)benzene})RhCl₂]₂; sodium carbonate; In n-heptane; at 140 ℃; for 36h; Sealed tube; Inert atmosphere; Molecular sieve;

DOI:10.1021/jacs.1c12622

Reference yield: 85.0%

piperidine (110-89-4) + 3-methylcyclohexen-2-one (1193-18-6) → N-(3-methylphenyl)piperidine (71982-24-6)

Guidance literature:

With PdCl₂(PMePh₂)2; oxygen; Potassium benzoate; benzoic acid; In toluene; at 100 ℃; for 36h; Sealed tube;

DOI:10.1021/ol3027279

upstream raw materials:

TETRAHYDROPYRANE

1-amino-3-methylbenzene

piperidine

diethyl ether

Downstream raw materials:

C₂₀H₂₂N₂O₂

C₂₀H₂₂N₂O₃

C₁₉H₁₉NO₂

1-(3-methylphenyl)-pyrrolidin-2-one