1H-Cyclohepta(b)pyridine-1-propanamide, N-(2-chloro-6-methylphenyl)decahydro-, trans-, ethanedioate (1:1)

Base Information

• Chemical Name: 1H-Cyclohepta(b)pyridine-1-propanamide, N-(2-chloro-6-methylphenyl)decahydro-, trans-, ethanedioate (1:1)
• CAS No.: 41920-90-5
• Molecular Formula: C22H31ClN2O5
• Molecular Weight: 438.9449
• DSSTox Substance ID: DTXSID50194685

Synonyms:1H-Cyclohepta(b)pyridine-1-propanamide, N-(2-chloro-6-methylphenyl)decahydro-, trans-, ethanedioate (1:1);41920-90-5;C20-H29-Cl-N2-O.C2-H2-O4;DTXSID50194685;LS-56025

Chemical Property of 1H-Cyclohepta(b)pyridine-1-propanamide, N-(2-chloro-6-methylphenyl)decahydro-, trans-, ethanedioate (1:1)

Chemical Property:

• Vapor Pressure: 2.84E-10mmHg at 25°C
• Boiling Point: 503.7°C at 760 mmHg
• Flash Point: 258.4°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 438.1921498
• Heavy Atom Count: 30
• Complexity: 488

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)Cl)NC(=O)CCN2CCCC3C2CCCCC3.C(=O)(C(=O)O)O
• Isomeric SMILES: CC1=C(C(=CC=C1)Cl)NC(=O)CCN2CCC[C@@H]3[C@@H]2CCCCC3.C(=O)(C(=O)O)O

Technology Process of 1H-Cyclohepta(b)pyridine-1-propanamide, N-(2-chloro-6-methylphenyl)decahydro-, trans-, ethanedioate (1:1)

There total 2 articles about 1H-Cyclohepta(b)pyridine-1-propanamide, N-(2-chloro-6-methylphenyl)decahydro-, trans-, ethanedioate (1:1) 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:

→ N-(2-Chloro-6-methyl-phenyl)-3-(4aR,9aS)-decahydro-cyclohepta[b]pyridin-1-yl-propionamide; compound with oxalic acid (39489-90-2,39494-03-6,41920-89-2,41920-90-5)

Guidance literature:

entspr. Xylidid, entspr. trans-bicycl. Amin;

DOI:10.1021/jm00262a019

Reference yield:

→ N-(2-Chloro-6-methyl-phenyl)-3-(4aS,9aS)-decahydro-cyclohepta[b]pyridin-1-yl-propionamide; compound with oxalic acid (39489-90-2,39494-03-6,41920-89-2,41920-90-5)

Guidance literature:

entspr. Xylidid, entspr. cis-bicycl. Amin;

DOI:10.1021/jm00262a019

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