Tridec-12-en-2-one

Base Information

• Chemical Name: Tridec-12-en-2-one
• CAS No.: 60437-21-0
• Molecular Formula: C13H24O
• Molecular Weight: 196.333
• Hs Code.: 2914190090
• DSSTox Substance ID: DTXSID30447222
• Nikkaji Number: J2.373.795G
• Wikidata: Q27453260
• Metabolomics Workbench ID: 5539
• Mol file: 60437-21-0.mol

Synonyms:Tridec-12-en-2-one;12-TRIDECEN-2-ONE;60437-21-0;12-Tridecene-2-one;SCHEMBL15753807;DTXSID30447222;CHEBI:186917;LMFA12000167;MFCD11553533;AKOS006324535;Q27453260

Chemical Property of Tridec-12-en-2-one

Chemical Property:

• PSA: 17.07000
• LogP: 4.27230
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 196.182715385
• Heavy Atom Count: 14
• Complexity: 149

Purity/Quality:

98.5% ^*data from raw suppliers

Tridec-12-en-2-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)CCCCCCCCCC=C

Technology Process of Tridec-12-en-2-one

There total 13 articles about Tridec-12-en-2-one 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: 92.0%

11-oxododecanal (36218-86-7) + bis(iodozinc)methane (31729-70-1) → tridec-12-en-2-one (60437-21-0)

Guidance literature:

In tetrahydrofuran;

DOI:10.1055/s-1998-1980

Reference yield: 60.0%

tridec-12-en-2-ol (96562-66-2) → tridec-12-en-2-one (60437-21-0)

Guidance literature:

With jones reagent; In acetone; for 0.166667h; Ambient temperature;

Reference yield: 51.0%

tridec-1-en-12-yne (92605-43-1) → tridec-12-en-2-one (60437-21-0)

Guidance literature:

With sulfuric acid; mercury(II) sulfate; In methanol; at 60 - 70 ℃; for 5h;

upstream raw materials:

1-iodo-10-undecene

dodec-11-enoyl chloride

methylzinc iodide

cyclotridecanone

Downstream raw materials:

tridecan-2-ol

tridecan-2-one

Refernces

• 1、 -. "PALLADIUM-CATALYZED DECARBONYLATION OF FATTY ACID ANHYDRIDES FOR THE PRODUCTION OF LINEAR ALPHA OLEFINS". Page/Page column. . Retrieved 2014/06/23.
• 2、 Mithran, S.,Subbaraman, A. S.,Mamdapur, V. R.. "A SHORT SYNTHESIS OF TRIDEC-12-EN-2-ONE, THE MINOR CONSTITUENT OF THE BARK OF LITSEA ELLIPTICA (LAURACEAE)". . p. 482 - 484. Retrieved 2007/10/02.