5-Hydroxyhexanoic acid

Base Information

• Chemical Name: 5-Hydroxyhexanoic acid
• CAS No.: 44843-89-2
• Molecular Formula: C₆H₁₂O₃
• Molecular Weight: 132.159
• DSSTox Substance ID: DTXSID10866119
• Nikkaji Number: J262.000F
• Metabolomics Workbench ID: 1291
• Mol file: 44843-89-2.mol

Synonyms:5-hydroxycaproate;5-hydroxycaproic acid;5-hydroxyhexanoic acid

Chemical Property of 5-Hydroxyhexanoic acid

Chemical Property:

• Vapor Pressure: 0.00148mmHg at 25°C
• Refractive Index: 1.46
• Boiling Point: 263.141 °C at 760 mmHg
• Flash Point: 127.196 °C
• PSA: 57.53000
• Density: 1.101 g/cm³
• LogP: 0.62210
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 132.078644241
• Heavy Atom Count: 9
• Complexity: 90.3

Purity/Quality:

99% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(CCCC(=O)O)O

Technology Process of 5-Hydroxyhexanoic acid

There total 7 articles about 5-Hydroxyhexanoic 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:

10,11,15-trihydroxy-hexadecanoic acid → 1,10-decanedioic acid (111-20-6,26776-29-4) + 5-hydroxyhexanoic acid (44843-89-2,83972-60-5,83972-61-6)

Guidance literature:

Reference yield:

→ 5-hydroxyhexanoic acid (44843-89-2,83972-60-5,83972-61-6)

Guidance literature:

With barium dihydroxide; das Salz entsteht;

Reference yield:

→ 5-hydroxyhexanoic acid (44843-89-2,83972-60-5,83972-61-6)

Guidance literature:

With sodium amalgam; auch ihr Lacton (δ-Caprolacton) entsteht;

upstream raw materials:

5-ketohexanoic acid

Downstream raw materials:

(R)-(+)-δ-methyl-δ-valerolactone

(S)-6-methyl-tetrahydro-pyran-2-one

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