Ethyl 1-aminocyclopent-3-enecarboxylate

Base Information

• Chemical Name: Ethyl 1-aminocyclopent-3-enecarboxylate
• CAS No.: 199532-88-2
• Molecular Formula: C8H13NO2
• Molecular Weight: 155.197
• DSSTox Substance ID: DTXSID40443639
• Nikkaji Number: J1.466.700H
• Mol file: 199532-88-2.mol

Synonyms:199532-88-2;ETHYL 1-AMINOCYCLOPENT-3-ENECARBOXYLATE;Ethyl 1-aminocyclopent-3-ene-1-carboxylate;1-AMINO-3-CYCLOPENTENE-1-CARBOXYLIC ACID ETHYL ESTER;3-Cyclopentene-1-carboxylicacid,1-amino-,ethylester(9CI);SCHEMBL7136776;DTXSID40443639;TQ0162;ETHYL1-AMINOCYCLOPENT-3-ENECARBOXYLATE;EN300-1700038

Chemical Property of Ethyl 1-aminocyclopent-3-enecarboxylate

Chemical Property:

• PSA: 52.32000
• LogP: 1.29730
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 155.094628657
• Heavy Atom Count: 11
• Complexity: 179

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1(CC=CC1)N

Technology Process of Ethyl 1-aminocyclopent-3-enecarboxylate

There total 11 articles about Ethyl 1-aminocyclopent-3-enecarboxylate 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: 83.0%

ethyl 1-((4-bromobenzylidene)amino)cyclopent-3-ene-1-carboxylate (199532-83-7) → ethyl 1-aminocyclopent-3-ene-1-carboxylate (199532-88-2)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; water; at 20 ℃;

DOI:10.1021/acs.jmedchem.0c01302

Reference yield: 83.0%

1-{[1-(4-Bromo-phenyl)-meth-(E)-ylidene]-amino}-cyclopent-3-enecarboxylic acid ethyl ester → ethyl 1-aminocyclopent-3-ene-1-carboxylate (199532-88-2)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; water; for 0.5h; Ambient temperature;

DOI:10.1021/jo9714831

Reference yield:

C15H24N2O2 (952193-59-8) → ethyl 1-aminocyclopent-3-ene-1-carboxylate (199532-88-2)

Guidance literature:

With water; trifluoroacetic acid; In acetonitrile; at 60 ℃; for 0.333333h; microwave irradiation;

DOI:10.1016/j.tet.2007.06.108

upstream raw materials:

(Z)-but-2-ene-1,4-diyl dimethanesulfonate

ethyl 1-((4-bromobenzylidene)amino)cyclopent-3-ene-1-carboxylate

C₁₅H₂₄N₂O₂

(2R,5S)-5-allyl-3,6-diethoxy-2,5-dihydro-2-isopropylpyrazine

Downstream raw materials:

C₁₄H₁₅NO₄S

C₁₄H₁₅NO₅S

C₁₇H₂₃NO₅SSi

1-tosyl-3-oxa-1-azaspiro[4.4]non-8-ene-2,7-dione