(1E)-2-Methoxy-3,8-dimethylazocine

Base Information

• Chemical Name: (1E)-2-Methoxy-3,8-dimethylazocine
• CAS No.: 20205-53-2
• Molecular Formula: C10H13NO
• Molecular Weight: 163.21600
• DSSTox Substance ID: DTXSID90701251
• Mol file: 20205-53-2.mol

Synonyms:20205-53-2;DTXSID90701251;(1E)-2-Methoxy-3,8-dimethylazocine

Chemical Property of (1E)-2-Methoxy-3,8-dimethylazocine

Chemical Property:

• PSA: 21.59000
• LogP: 1.88680
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 163.099714038
• Heavy Atom Count: 12
• Complexity: 282

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C(N=C1OC)C

Technology Process of (1E)-2-Methoxy-3,8-dimethylazocine

There total 3 articles about (1E)-2-Methoxy-3,8-dimethylazocine 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:

3,8-dimethyl-2-methoxyazocine anion radical (20205-53-2) → 3,8-Dimethyl-2-methoxyazocin (20205-53-2) + 3,8-dimethyl-2-methoxyazocine dianion (20205-53-2)

Guidance literature:

In N,N,N,N,N,N-hexamethylphosphoric triamide; at 0 ℃; Rate constant; Thermodynamic data; ΔH⁰_disp - enhtalpy and rate constant for disproportionation process;

DOI:10.1021/ja00357a019

Reference yield:

3,8-dimethyl-2-methoxyazocine anion radical (20205-53-2) → 3,8-Dimethyl-2-methoxyazocin (20205-53-2) + 3,8-dimethyl-2-methoxyazocine dianion (20205-53-2)

Guidance literature:

In N,N,N,N,N,N-hexamethylphosphoric triamide; at 0 ℃; Rate constant; Thermodynamic data; ΔH⁰_disp - enhtalpy and rate constant for disproportionation process;

DOI:10.1021/ja00357a019

Reference yield:

→ 3,8-Dimethyl-2-methoxyazocin (20205-53-2)

Guidance literature:

1,6-Dimethyl-8-methoxy-7-azabicyclo<4.2.0>octadien-(3,7) 1. N-Bromsuccinimid, in CCl4 2. K-tert-Butylat;

DOI:10.1021/ja01016a073