N-Ethyl-3-phenyl-1-propanamine hydrochloride

Base Information

• Chemical Name: N-Ethyl-3-phenyl-1-propanamine hydrochloride
• CAS No.: 13125-63-8
• Molecular Formula: C₁₁H₁₇N*ClH
• Molecular Weight: 199.724
• European Community (EC) Number: 642-125-9
• Mol file: 13125-63-8.mol

Synonyms:13125-63-8;N-Ethyl-3-phenyl-1-propanamine hydrochloride;N-Ethyl-3-phenylpropan-1-amine hydrochloride;Alverine Citrate Impurity C;N-ethyl-3-phenylpropan-1-amine;hydrochloride;Alverine Citrate Imp. C (EP);Alverine Imp. C (EP);N-Ethyl-3-phenylpropan-1-amine Hydrochloride;Alverine Citrate Imp. C (EP) as Hydrochloride;Alverine Citrate Impurity C as Hydrochloride;Alverine Impurity C as Hydrochloride;SCHEMBL8508325;MFCD08559359;N-Ethyl-3-phenyl-1-propanamine HCl;AKOS005111271;MCULE-8743949752;BS-37315;N-Ethyl-3-phenylpropan-1-aminehydrochloride;ETHYL(3-PHENYLPROPYL)AMINE HYDROCHLORIDE

Chemical Property of N-Ethyl-3-phenyl-1-propanamine hydrochloride

Chemical Property:

• Melting Point: 152 °C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 199.1127773
• Heavy Atom Count: 13
• Complexity: 95.2

Purity/Quality:

99.90% ^*data from raw suppliers

N-ethyl-3-phenyl-1-propanaminehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCNCCCC1=CC=CC=C1.Cl

Technology Process of N-Ethyl-3-phenyl-1-propanamine hydrochloride

There total 3 articles about N-Ethyl-3-phenyl-1-propanamine hydrochloride 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: 83.0%

N-acetyl-3-phenylpropylamine (34059-10-4) → N-ethyl-3-phenylpropan-1-amine hydrochloride (13125-63-8)

Guidance literature:

N-acetyl-3-phenylpropylamine; With phenylsilane-d3; C₃₆H₄₈F₆N₆NiO₅S₂; In toluene; at 110 ℃; for 24h; Inert atmosphere; Schlenk technique;

With hydrogenchloride; In diethyl ether;

DOI:10.1039/d1cc03537a

Reference yield: 76.0%

N-ethyl-3-phenylpropionamide (81256-39-5) → N-ethyl-3-phenylpropan-1-amine hydrochloride (13125-63-8)

Guidance literature:

N-ethyl-3-phenylpropionamide; With bis(cyclopentadienyl)dihydrozirconium; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; at 20 ℃; for 12h; under 760.051 Torr; Inert atmosphere;

With hydrogenchloride; In diethyl ether; Inert atmosphere;

Reference yield:

3-Phenylpropan-1-amine (2038-57-5) → N-ethyl-3-phenylpropan-1-amine hydrochloride (13125-63-8)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 2 h / 20 °C

2: C₃₆H₄₈F₆N₆NiO₅S₂; phenylsilane-d3 / toluene / 24 h / 110 °C / Inert atmosphere; Schlenk technique

With phenylsilane-d3; C₃₆H₄₈F₆N₆NiO₅S₂; triethylamine; In dichloromethane; toluene;

DOI:10.1039/d1cc03537a

upstream raw materials:

N-ethyl-3-phenylpropionamide

3-Phenylpropan-1-amine

N-acetyl-3-phenylpropylamine

Downstream raw materials:

7-{3-[Ethyl-(3-phenyl-propyl)-amino]-propoxy}-chromen-4-one

Refernces

• 1、 Pandey, Pragati,Bera, Jitendra K.. "Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex". . p. 9204 - 9207. Retrieved 2021/09/20.