Tetranor-12R-HETE

Base Information

• Chemical Name: Tetranor-12R-HETE
• CAS No.: 135271-51-1
• Molecular Formula: C16H26O3
• Molecular Weight: 266.38
• DSSTox Substance ID: DTXSID90425006
• Wikidata: Q27140009
• Metabolomics Workbench ID: 1353
• Mol file: 135271-51-1.mol

Synonyms:Tetranor-12R-HETE;tetranor-12(R)-HETE;8R-hydroxy-4Z,6E,10Z-hexadecatrienoic acid;135271-51-1;tetranor-12-HETE;8(R)-HHxTrE;BML1-B12;CHEBI:72605;(4Z,6E,8R,10Z)-8-hydroxyhexadeca-4,6,10-trienoic acid;DTXSID90425006;LMFA01050143;AKOS040756032;NCGC00161245-01;8S-Hydroxy-4Z,6E,10Z-hexadecatrienoic acid;SR-01000946926;J-006673;SR-01000946926-1;Q27140009

Chemical Property of Tetranor-12R-HETE

Chemical Property:

• PSA: 57.53000
• LogP: 3.85110
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 11
• Exact Mass: 266.18819469
• Heavy Atom Count: 19
• Complexity: 303

Purity/Quality:

95% ^*data from raw suppliers

tetranor-12(R)-HETE ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC=CCC(C=CC=CCCC(=O)O)O
• Isomeric SMILES: CCCCC/C=C\C[C@H](/C=C/C=C\CCC(=O)O)O

Technology Process of Tetranor-12R-HETE

There total 1 articles about Tetranor-12R-HETE 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:

3-Carboxypropylidenetriphenylphosphorane (63129-91-9) + Toluene-4-sulfonic acid (2R,3S)-5-hydroxy-2-((Z)-oct-2-enyl)-tetrahydro-furan-3-yl ester (135236-80-5,135236-82-7) → 8(R)-Hydroxyhexadeca-4(Z),6(E),10(Z)-trienoic acid (135271-51-1,111916-07-5,121842-79-3)

Guidance literature:

In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; at -20 ℃; for 1h;

DOI:10.1016/S0040-4039(00)79912-6

upstream raw materials:

3-Carboxypropylidenetriphenylphosphorane

Toluene-4-sulfonic acid (2R,3S)-5-hydroxy-2-((Z)-oct-2-enyl)-tetrahydro-furan-3-yl ester