11-Hydroxytetradecanoic acid

Base Information

• Chemical Name: 11-Hydroxytetradecanoic acid
• CAS No.: 2034-56-2
• Molecular Formula: C₁₄H₂₈O₃
• Molecular Weight: 244.375
• Hs Code.: 2918199090
• DSSTox Substance ID: DTXSID80942494
• Nikkaji Number: J297.062G
• Metabolomics Workbench ID: 1380
• Mol file: 2034-56-2.mol

Synonyms:11-hydroxytetradecanoic acid

Chemical Property of 11-Hydroxytetradecanoic acid

Chemical Property:

• Vapor Pressure: 2.14E-07mmHg at 25°C
• Boiling Point: 381.7°Cat760mmHg
• Flash Point: 198.8°C
• PSA: 57.53000
• Density: 0.969g/cm³
• LogP: 3.74290
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 12
• Exact Mass: 244.20384475
• Heavy Atom Count: 17
• Complexity: 180

Purity/Quality:

99% ^*data from raw suppliers

11-Hydroxy myristic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(CCCCCCCCCC(=O)O)O
• Uses: A possible fatty acyl pheromone precursors in Spodoptera littoralis A possible fatty acyl pheromone precursors in Spodoptera littoralis.

Technology Process of 11-Hydroxytetradecanoic acid

There total 3 articles about 11-Hydroxytetradecanoic acid 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:

n-tetradecanoic acid (544-63-8) → 11-hydroxymyristic acid (2034-56-2) + 10-hydroxytetradecanoic acid (16899-08-4) + 13-Hydroxymyristic acid (17278-73-8) + 12-hydroxytetradecanoic acid (82177-86-4) + 9-hydroxytetradecanoic acid (103273-05-8)

Guidance literature:

With glucose-6-phosphate dehydrogenase; D-glucose 6-phosphate; Sorangium cellulosum So ce56 cytochrome P₁₀₉D₁; Sorangium cellulosum So ce56 His-tagged ferredoxin reductase; NADP; magnesium chloride; for 0.5h; regioselective reaction; aq. buffer; Enzymatic reaction;

DOI:10.1016/j.chembiol.2010.10.010

Reference yield:

n-tetradecanoic acid (544-63-8) → 11-hydroxymyristic acid (2034-56-2) + 13-Hydroxymyristic acid (17278-73-8) + 12-hydroxytetradecanoic acid (82177-86-4)

Guidance literature:

With wildtype P_450BM3; NADPH; catalase; In phosphate buffer; at 37 ℃; for 0.5h; Title compound not separated from byproducts;

DOI:10.1016/j.tetasy.2007.01.034

Reference yield:

n-tetradecanoic acid (544-63-8) → 11-hydroxymyristic acid (2034-56-2) + 14-hydroxymyristic acid (17278-74-9) + 13-Hydroxymyristic acid (17278-73-8) + 12-hydroxytetradecanoic acid (82177-86-4)

Guidance literature:

With oxygen; NADPH; monooxygenase CYP₁₀₂A₁ mutant A₇₄G,F₈₇V,L₁₈₈Q,R₉₆₆D,W₁₀₄₆S; In phosphate buffer; dodecane; at 20 ℃; for 24h; pH=6; Further Variations:; Reagents; Enzyme kinetics;

DOI:10.1002/adsc.200505044

upstream raw materials:

n-tetradecanoic acid

Refernces

• 1、 Cryle, Max J.,De Voss, James J.. "Facile determination of the absolute stereochemistry of hydroxy fatty acids by GC: application to the analysis of fatty acid oxidation by a P450BM3 mutant". . p. 547 - 551. Retrieved 2007/10/03.