Aletamine

Base Information

• Chemical Name: Aletamine
• CAS No.: 4255-23-6
• Molecular Formula: C11H15N
• Molecular Weight: 161.24
• Hs Code.: 2921499090
• UNII: Q3V87119BP
• DSSTox Substance ID: DTXSID60863350
• Nikkaji Number: J8.695I
• Wikipedia: Alfetamine
• Wikidata: Q4721900
• NCI Thesaurus Code: C78005
• ChEMBL ID: CHEMBL2110598
• Mol file: 4255-23-6.mol

Synonyms:aletamine;aletamine hydrochloride;aletamine hydrochloride, (+-)-isomer;alfetadrine;alfetamin;alfetamine

Chemical Property of Aletamine

Chemical Property:

• Vapor Pressure: 0.0232mmHg at 25°C
• Refractive Index: 1.531
• Boiling Point: 249.2°C at 760 mmHg
• Flash Point: 103.6°C
• PSA: 26.02000
• Density: 0.943g/cm³
• LogP: 2.83280
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 161.120449483
• Heavy Atom Count: 12
• Complexity: 125

Purity/Quality:

Aletamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCC(CC1=CC=CC=C1)N
• Uses: Antidepressant.

Technology Process of Aletamine

There total 2 articles about Aletamine 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:

2-benzylpent-4-enamide (7154-69-0) → aletamine (4255-23-6)

Guidance literature:

With sodium hydroxide; bromine;

DOI:10.1016/S0960-894X(96)00563-X

Reference yield:

→ aletamine (4255-23-6)

Guidance literature:

2-Benzylpent-4-ensaeureamid, NaOBr;

DOI:10.1021/jm00309a028

Reference yield:

aletamine (4255-23-6) → N-((2R,4S)-2-Benzyl-piperidin-4-yl)-acetamide

Guidance literature:

Multi-step reaction with 4 steps

1: NaHCO₃ / H₂O

2: 80 percent / NaOH, benzyltributylammonium chloride / H₂O; CH₂Cl₂ / 5 - 10 °C

3: ClSO₃H / 0.5 h / -20 °C

4: 93 percent / HCl / H₂O / 50 °C

With hydrogenchloride; chlorosulfonic acid; sodium hydroxide; benzyltri(n-butyl)ammonium chloride; sodium hydrogencarbonate; In dichloromethane; water;

DOI:10.1016/S0960-894X(96)00563-X

upstream raw materials:

2-benzylpent-4-enamide

Downstream raw materials:

N-benzyloxycarbonyl-(+/-)-1-benzylbut-3-enylamine

(1-Benzyl-but-3-enyl)-ethoxymethyl-carbamic acid benzyl ester

Refernces