Lennoxamine

Base Information

• Chemical Name: Lennoxamine
• CAS No.: 95530-38-4
• Molecular Formula: C₂₀H₁₉NO₅
• Molecular Weight: 353.375
• UNII: EKT38NF7FQ
• DSSTox Substance ID: DTXSID20448602
• Nikkaji Number: J690.656G
• Wikipedia: Lennoxamine
• Wikidata: Q621936
• Mol file: 95530-38-4.mol

Synonyms:lennoxamine

Chemical Property of Lennoxamine

Chemical Property:

• Melting Point: 234 - 235 °C
• Boiling Point: 551.3°Cat760mmHg
• Flash Point: 287.2°C
• PSA: 57.23000
• Density: 1.41g/cm³
• LogP: 2.66610
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 353.12632271
• Heavy Atom Count: 26
• Complexity: 556

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C2=C(C=C1)C3CC4=CC5=C(C=C4CCN3C2=O)OCO5)OC

Technology Process of Lennoxamine

There total 2 articles about Lennoxamine 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: 73.0%

(6-bromo-2,3-dimethoxy-phenyl)-(5,6-dihydro-1,3-dioxa-7-aza-cyclohepta[f]inden-7-yl)-methanone (385390-30-7) → lennoxamine (38542-77-7,95530-38-4) + (5,6-dihydro-1,3-dioxa-7-aza-cyclohepta[f]inden-7-yl)-(2,3-dimethoxy-phenyl)-methanone (1027476-73-8)

Guidance literature:

With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride; In benzene; for 8h; Inert atmosphere; Reflux;

DOI:10.1021/jo900311g

Reference yield: 32.0%

N-ethenyl-N-[2-(5-iodobenzo[d][1,3]dioxol-6-yl)ethyl]-2,3-dimethoxybenzamide (868053-19-4) → 2,3,4,5-tetrahydro-2-[(2,3-dimethoxy)benzoyl]-1H-3-(7,8-methylenedioxy)benzoazepine + lennoxamine (38542-77-7,95530-38-4)

Guidance literature:

With tri-n-butyl-tin hydride; In toluene; for 2h; Heating;

DOI:10.1021/ol051563o

upstream raw materials:

(6-bromo-2,3-dimethoxy-phenyl)-(5,6-dihydro-1,3-dioxa-7-aza-cyclohepta[f]inden-7-yl)-methanone

N-ethenyl-N-[2-(5-iodobenzo[d][1,3]dioxol-6-yl)ethyl]-2,3-dimethoxybenzamide

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