2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl N-(2,4-dichlorophenoxy)sulfonylcarbamate

Base Information

• Chemical Name: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl N-(2,4-dichlorophenoxy)sulfonylcarbamate
• CAS No.: 5816-82-0
• Molecular Formula: C17H22Cl2N2O5S
• Molecular Weight: 437.338
• DSSTox Substance ID: DTXSID00410887

Synonyms:5816-82-0;2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl N-(2,4-dichlorophenoxy)sulfonylcarbamate;AC1NQCZ5;DTXSID00410887

Chemical Property of 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl N-(2,4-dichlorophenoxy)sulfonylcarbamate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.46g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 436.0626484
• Heavy Atom Count: 27
• Complexity: 615

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN2CCCC(C2C1)COC(=O)NS(=O)(=O)OC3=C(C=C(C=C3)Cl)Cl

Technology Process of 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl N-(2,4-dichlorophenoxy)sulfonylcarbamate

There total 1 articles about 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl N-(2,4-dichlorophenoxy)sulfonylcarbamate 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:

→ (4-chloro-benzoyl)-carbamoyl azide (5816-82-0)

Guidance literature:

<4-Chlor-benzoyl>-isocyanat, Stickstoffwasserstoffsaeure in Benzol;

Reference yield:

(4-chloro-benzoyl)-carbamoyl azide (5816-82-0) → 5-(4-chloro-phenyl)-[1,2,4]oxadiazol-3-one (21084-85-5)

Guidance literature:

In benzene; Irradiation;

Reference yield:

(4-chloro-benzoyl)-carbamoyl azide (5816-82-0) → 3-methoxy-5-(4-chlorophenyl)-1,2,4-oxadiazole (21084-91-3)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene / Irradiation

2: methanol; H₂O

In methanol; water; benzene;

Downstream raw materials:

2-(4-chloro-phenyl)-oxazol-4-one

5-(4-chloro-phenyl)-[1,2,4]oxadiazol-3-one

3-methoxy-5-(4-chlorophenyl)-1,2,4-oxadiazole

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