Ethyl cyclopent-1-enecarboxylate

Base Information

• Chemical Name: Ethyl cyclopent-1-enecarboxylate
• CAS No.: 10267-94-4
• Molecular Formula: C8H12 O2
• Molecular Weight: 140.182
• Hs Code.: 2916209090
• NSC Number: 122558
• DSSTox Substance ID: DTXSID40298323
• Nikkaji Number: J81.478D
• Wikidata: Q72474082
• Mol file: 10267-94-4.mol

Synonyms:10267-94-4;ethyl cyclopent-1-enecarboxylate;Ethyl 1-cyclopentene-1-carboxylate;ethyl cyclopentene-1-carboxylate;ethyl cyclopent-1-ene-1-carboxylate;Cyclopentene-1-carboxylic acid ethyl ester;NSC122558;1-Cyclopentene-1-carboxylic acid, ethyl ester;SCHEMBL340678;ethylcyclopent-1-enecarboxylate;DTXSID40298323;MFCD00154485;AKOS024262275;NSC-122558;AM802851;AS-66654

Chemical Property of Ethyl cyclopent-1-enecarboxylate

Chemical Property:

• Vapor Pressure: 0.771mmHg at 25°C
• Boiling Point: 183.4°Cat760mmHg
• Flash Point: 62.6°C
• PSA: 26.30000
• Density: 1.045g/cm³
• LogP: 1.65980
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 140.083729621
• Heavy Atom Count: 10
• Complexity: 159

Purity/Quality:

98%,99%, ^*data from raw suppliers

Ethylcyclopent-1-enecarboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CCCC1

Technology Process of Ethyl cyclopent-1-enecarboxylate

There total 3 articles about Ethyl cyclopent-1-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:

ethyl 2-(1-hydroxycyclopentyl)acetate (3197-76-0) → ethyl cyclopent-1-enecarboxylate (10267-94-4) + ethyl cyclopentylideneacetate (1903-22-6) + ethyl cyclopenten-1-ylacetate (57647-92-4)

Guidance literature:

With pyridine; thionyl chloride; for 46h; Title compound not separated from byproducts;

DOI:10.1021/ja00267a036

Reference yield:

→ ethyl cyclopent-1-enecarboxylate (10267-94-4) + ethyl cyclopent-2-enyl carboxylate (5809-02-9)

Guidance literature:

With phosphorus pentoxide; benzene;

Reference yield:

ethyl 1-chloro-2-oxocyclohexanecarboxylate (59736-20-8) + sodium acetate (127-09-3) + acetic acid (64-19-7,77671-22-8) → ethyl cyclopent-1-enecarboxylate (10267-94-4) + 1-Acetoxy-2-oxo-cyclohexan-carbonsaeure-(1)-aethylester (91353-33-2)

Guidance literature:

upstream raw materials:

ethyl 2-(1-hydroxycyclopentyl)acetate

ethyl 1-chloro-2-oxocyclohexanecarboxylate

sodium acetate

acetic acid

Downstream raw materials:

cyclopent-1-enecarboxylic acid

1-benzyl-1-oxo-2-phenyl-hexahydro-1λ⁵-cyclopenta[b]phosphol-3-one

1t-benzyl-1c-oxo-2ξ-phenyl-(3ar,6at)-hexahydro-1λ⁵-cyclopenta[b]phosphol-3-one

1-oxo-1,2-diphenyl-hexahydro-1λ⁵-cyclopenta[b]phosphol-3-one

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