5-Hydroxydecanoic acid

Base Information

• Chemical Name: 5-Hydroxydecanoic acid
• CAS No.: 624-00-0
• Molecular Formula: C10H20O3
• Molecular Weight: 188.267
• DSSTox Substance ID: DTXSID10977956
• Nikkaji Number: J262.022G
• Metabolomics Workbench ID: 1308
• ChEMBL ID: CHEMBL1373782
• Mol file: 624-00-0.mol

Synonyms:5-hydroxydecanoate;5-hydroxydecanoic acid;5-hydroxydecanoic acid, monosodium salt;sodium 5-hydroxydecanoate

Chemical Property of 5-Hydroxydecanoic acid

Chemical Property:

• Vapor Pressure: 2.52E-05mmHg at 25°C
• Melting Point: 155-157°C
• Boiling Point: 320.8°C at 760 mmHg
• Flash Point: 162°C
• PSA: 57.53000
• Density: 1.011g/cm³
• LogP: 2.18250
• Storage Temp.: Refrigerator
• Solubility.: H2O: soluble
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 188.14124450
• Heavy Atom Count: 13
• Complexity: 134

Purity/Quality:

98%min ^*data from raw suppliers

5-HYDROXYDECANOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCC(CCCC(=O)O)O
• Uses: A potassium channel antagonist which blocks the postischemic effects of the potassium channel activator cromakalim

Technology Process of 5-Hydroxydecanoic acid

There total 8 articles about 5-Hydroxydecanoic 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:

1-decanoic acid (334-48-5) → 5-hydroxydecanoic acid (624-00-0) + (+/-)-δ-decanolactone (705-86-2)

Guidance literature:

With cytochrome P₄₅₀ monooxygenase from Tepidiphilus thermophilus; In decane; at 20 ℃; Reagent/catalyst; Solvent; Temperature; Catalytic behavior;

DOI:10.1002/anie.201901242

Reference yield:

1-decanoic acid (334-48-5) → 6-hydroxydecanoic acid (16899-10-8) + 5-hydroxydecanoic acid (624-00-0)

Guidance literature:

With D-glucose; cytochrome P₄₅₀ monooxygenase from Tepidiphilus thermophilus; In aq. phosphate buffer; at 30 ℃; for 24h; pH=8; regioselective reaction; Enzymatic reaction;

DOI:10.1002/anie.201901242

Reference yield:

1-decanoic acid (334-48-5) → 6-hydroxydecanoic acid (16899-10-8) + 9-hydroxydecanoic acid (1422-27-1) + 5-hydroxydecanoic acid (624-00-0)

Guidance literature:

With D-glucose; cytochrome P₄₅₀ monooxygenase from JT; In aq. phosphate buffer; at 30 ℃; for 24h; pH=8; regioselective reaction; Enzymatic reaction;

DOI:10.1002/anie.201901242

upstream raw materials:

methyl 5-oxodecanoate

5-dodecanolide

1-decanoic acid

Downstream raw materials:

1,5-pentanedioic acid

pentan-1-ol

4-hydroxybutanoic acid

hexanoic acid

Refernces

• 1、 Manning, Jack,Tavanti, Michele,Porter, Joanne L.,Kress, Nico,De Visser, Sam P.,Turner, Nicholas J.,Flitsch, Sabine L.. "Regio- and Enantio-selective Chemo-enzymatic C?H-Lactonization of Decanoic Acid to (S)-δ-Decalactone". . p. 5668 - 5671. Retrieved 2019/03/29.