Ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate

Base Information

• Chemical Name: Ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate
• CAS No.: 199725-38-7
• Molecular Formula: C₁₄H₁₈N₂O₂
• Molecular Weight: 246.309
• DSSTox Substance ID: DTXSID40694068
• Mol file: 199725-38-7.mol

Synonyms:199725-38-7;Ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate;ethyl 1,3,4,4a,5,9b-hexahydropyrido[4,3-b]indole-2-carboxylate;Ethyl 3,4,4a,5-tetrahydro-1H-pyrido[4,3-b]indole-2(9bH)-carboxylate;DTXSID40694068;rel-((4aS,9bR)-ethyl 3,4,4a,5-tetrahydro-1H-pyrido[4,3-b]indole-2(9bH)-carboxylate);MB69320;FT-0656166;A814122;1,3,4,4a,5,9b-hexahydropyrido[4,3-b]indole-2-carboxylic acid ethyl ester;Ethyl 1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate;Ethyl3,4,4a,5-tetrahydro-1h-pyrido[4,3-b]indole-2(9bh)-carboxylate

Chemical Property of Ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate

Chemical Property:

• Flash Point: 181.3 ºC
• PSA: 41.57000
• Density: 1.163
• LogP: 2.50240
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 246.136827821
• Heavy Atom Count: 18
• Complexity: 321

Purity/Quality:

98%min ^*data from raw suppliers

ETHYL 3,4,4A,5-TETRAHYDRO-1H-PYRIDO[4,3-B]INDOLE-2(9BH)-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N1CCC2C(C1)C3=CC=CC=C3N2

Technology Process of Ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate

There total 1 articles about Ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate 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:

methanol (67-56-1) + ethyl 1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate (63277-54-3) → (+/-)-ethyl cis-1,3,4,4a,5,9b-hexahydro-2H-pyrido[4,3-b]indole-2-carboxylate (199725-38-7)

Guidance literature:

With hydrogenchloride; aluminum nickel; In diethyl ether; ammonia; water;

upstream raw materials:

methanol

ethyl 1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate

Refernces