methyl N-[11-(2-piperidin-1-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride

Base Information

• Chemical Name: methyl N-[11-(2-piperidin-1-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride
• CAS No.: 5691-55-4
• Molecular Formula: C₁₀H₁₂O₄
• Molecular Weight: 196.203
• DSSTox Substance ID: DTXSID00386412
• Mol file: 5691-55-4.mol

Synonyms:5691-55-4;methyl N-[11-(2-piperidin-1-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride;AC1MEWWS;Cambridge id 5691554;DTXSID00386412

Chemical Property of methyl N-[11-(2-piperidin-1-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride

Chemical Property:

• Vapor Pressure: 5.8E-13mmHg at 25°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 443.1975695
• Heavy Atom Count: 31
• Complexity: 607

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC)N4CCCCC4.Cl

Technology Process of methyl N-[11-(2-piperidin-1-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride

There total 5 articles about methyl N-[11-(2-piperidin-1-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;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:

2,6-dihydroxy-3,5-dimethyl-1,4-benzoquinone (6717-01-7) → 2,6-dimethoxy-3,5-dimethyl-1,4-benzoquinone (5691-55-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 2.) acid, H₂O

With water;

Reference yield:

diacetyl peroxide (110-22-5) + 2,6-dimethoxy-p-quinone (530-55-2,26547-64-8) → 2,6-dimethoxy-3,5-dimethyl-1,4-benzoquinone (5691-55-4)

Guidance literature:

With acetic acid;

DOI:10.1039/jr9420000577

Reference yield:

diazomethane (186581-53-3,908094-01-9,334-88-3) + 2-hydroxy-6-methoxy-3,5-dimethyl-[1,4]benzoquinone (76186-46-4) → 2,6-dimethoxy-3,5-dimethyl-1,4-benzoquinone (5691-55-4)

Guidance literature:

upstream raw materials:

diacetyl peroxide

2,6-dimethoxy-p-quinone

diazomethane

2,6-dihydroxy-3,5-dimethyl-1,4-benzoquinone

Refernces

• 1、 Soga, Osamu,Iwamoto, Hidetoshi. "Isolation of a New Natural Quinone, 2-Hydroxy-6-methoxy-3,5-dimethyl-1,4-benzoquinone, from the Potato Culture Solution of Phoma wasabiae Yokogi". . p. 1497 - 1498. Retrieved 2007/10/02.