1,5-Cyclooctadiene

Base Information

• Chemical Name: 1,5-Cyclooctadiene
• CAS No.: 17612-50-9
• Deprecated CAS: 1552-12-1
• Molecular Formula: C₈H₁₂
• Molecular Weight: 108.183
• European Community (EC) Number: 203-907-1,216-291-4,235-538-7
• NSC Number: 60155
• UN Number: 2520
• UNII: 1E1VVD385Z
• Nikkaji Number: J130.630H,J152.067I,J152.222A,J40.583C,J45.012J
• Wikipedia: 1,5-Cyclooctadiene
• Wikidata: Q161547
• Mol file: 17612-50-9.mol

Synonyms:1,5-cyclooctadiene

Chemical Property of 1,5-Cyclooctadiene

Chemical Property:

• Boiling Point: 153.5°Cat760mmHg
• Flash Point: 31.7°C
• PSA: 0.00000
• Density: 0.841g/cm³
• LogP: 2.67280
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 108.093900383
• Heavy Atom Count: 8
• Complexity: 72.6

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Aliphatics, Unsaturated
• Canonical SMILES: C1CC=CCCC=C1
• Isomeric SMILES: C1/C=C\CC/C=C\C1
• Recent ClinicalTrials: Acute Effects of Dietary Proteins on Postprandial Lipemia, Incretin Responses and Subclinical Inflammation in Obese Subjects

Technology Process of 1,5-Cyclooctadiene

There total 1 articles about 1,5-Cyclooctadiene 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:

1,5-cis,cis-cyclooctadiene (1552-12-1,111-78-4) → R-(-)-cis,trans-1,5-cyclo-octadiene (111-78-4,1552-12-1,5259-71-2,5259-72-3,10060-40-9,10092-71-4,17612-50-9) + (+)-(E,Z)-cycloocta-1,5-diene

Guidance literature:

With (-)-1-methylheptyl benzene-1,2,4,5-tetracarboxylate; In pentane; at 25 ℃; under 750075 Torr; Further Variations:; Pressures; Product distribution; UV-irradiation;

DOI:10.1039/b202699f

Reference yield: 95.0%

trans,trans-1,5-cyclooctadiene (17612-50-9) + C15H20N4O8 (1422540-98-4) → 2-(2-(2-(2-((3aSR,9aSR,E)-3a,4,5,8,9,9a-hexahydro-1H-cycloocta[d][1,2,3]triazol-1-yl)ethoxy)ethoxy)ethoxy)ethyl (4-nitrophenyl) carbonate

Guidance literature:

In dichloromethane; at 20 ℃;

DOI:10.1021/acs.bioconjchem.0c00375

Reference yield: 88.0%

trans,trans-1,5-cyclooctadiene (17612-50-9) + N-methyl-α-phenylnitrone (3376-23-6) → (3aRS,9aSR,E)-2-methyl-3-phenyl-2,3,3a,4,5,8,9,9a-octahydrocycloocta[d]isoxazole

Guidance literature:

In dichloromethane;

DOI:10.1021/acs.bioconjchem.0c00375

upstream raw materials:

1,5-cis,cis-cyclooctadiene

Downstream raw materials:

1,5-cis,cis-cyclooctadiene

S-(+)-1,2-trans-2,9-trans-9,10-trans-tricyclo-<8.6.0.0^2,9>hexadeca-cis-5-cis-13-diene

1,2-cis-9,10-trans-tricyclo-<8.6.0.0^2,9>hexadeca-cis-5-cis-13-diene

(+)-1,2-cis-9,10-trans-tricyclo-<8.6.0.0^2,9>hexadeca-cis-5-cis-13-diene

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