Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-carboxylate

Base Information

• Chemical Name: Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-carboxylate
• CAS No.: 943-34-0
• Molecular Formula: C₁₀H₁₅NO₂
• Molecular Weight: 181.235
• NSC Number: 82085
• DSSTox Substance ID: DTXSID90915694
• Nikkaji Number: J54.655K
• Mol file: 943-34-0.mol

Synonyms:943-34-0;Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-carboxylate;NSC 82085;Ethyl 3-azatricyclo(3.2.1.0(sup 2,4))octane-3-carboxylate;3-AZATRICYCLO(3.2.1.0(sup 2,4))OCTANE-3-CARBOXYLIC ACID, ETHYL ESTER;3-Azatricyclo(3.2.1.02,4)octane-3-carboxylic acid, ethyl ester;Ethyl 3-azatricyclo[3.2.1.0(sup2,4)]octane-3-carboxylate;3-Azatricyclo[3.2.1.02,4]octane-3-carboxylic acid, ethyl ester;NSC82085;NCIOpen2_000840;DTXSID90915694;NSC-82085;3-Azatricyclo[3.2.1.02, ethyl ester;LS-22759;3-Azatricyclo[3.2.1.0(sup2, ethyl ester;Ethyl 3-azatricyclo[3.2.1.0~2,4~]octane-3-carboxylate

Chemical Property of Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-carboxylate

Chemical Property:

• Vapor Pressure: 0.0136mmHg at 25°C
• Boiling Point: 258.6°C at 760 mmHg
• Flash Point: 110.2°C
• Density: 1.215g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 181.110278721
• Heavy Atom Count: 13
• Complexity: 237

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N1C2C1C3CCC2C3

Technology Process of Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-carboxylate

There total 3 articles about Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-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: 20.0%

norbornene (498-66-8) + ethyl N-{[(4-nitrobenzene)sulfonyl]oxy}carbamate (2955-74-0) → 3-ethoxycarbonyl-3-azatricyclo<3.2.1.02,4>octane (943-34-0,14098-08-9,77447-87-1)

Guidance literature:

With triethylamine; In dichloromethane; for 3h;

DOI:10.1016/S0040-4020(01)96535-4

Reference yield:

→ N-Ethoxycarbonyl-3-azatricyclo<3,2,1,02,4>octan (943-34-0,14098-08-9,77447-87-1)

Guidance literature:

Verb. 3, Photolyse;

DOI:10.1139/v75-144

Reference yield:

→ 3-Carbethoxy-3-azatricyclo<3.2.1.02,4>octan (943-34-0,14098-08-9,77447-87-1)

Guidance literature:

3-Carbethoxy-3,4,5-triazatricyclo<5.2.1.0^2,6>dec-4-en, Bestrahlung;

upstream raw materials:

norbornene

ethyl N-{[(4-nitrobenzene)sulfonyl]oxy}carbamate