3-Hydroxynonanoic acid

Base Information

• Chemical Name: 3-Hydroxynonanoic acid
• CAS No.: 33796-87-1
• Molecular Formula: C9H18O3
• Molecular Weight: 174.24
• Hs Code.: 2918199090
• DSSTox Substance ID: DTXSID70955371
• Nikkaji Number: J262.013H
• Metabolomics Workbench ID: 1302
• Mol file: 33796-87-1.mol

Synonyms:3-HYDROXYNONANOIC ACID;40165-87-5;33796-87-1;3-oxidanylnonanoic acid;88930-09-0;(+/-)-3-Hydroxynonanoic Acid;3-hydroxy-nonanoic acid;(+)-3-hydroxy pelargonic acid;[R,(-)]-3-Hydroxynonanoic acid;MFCD00210303;Nonanoic acid, 3-hydroxy-, (A+/-)-;beta-hydroxynonanoic acid;()-3-Hydroxynonanoic acid;SCHEMBL310347;DTXSID70955371;CHEBI:156185;FA 9:0+1O;LMFA01050025;AKOS011680661;SB85216;SS-4993;Methyl4-oxo-3-piperidinecarboxylate HCL;9:0(3-OH);CS-0327437;FT-0639616;A824951

Chemical Property of 3-Hydroxynonanoic acid

Chemical Property:

• Vapor Pressure: 9.07E-05mmHg at 25°C
• Boiling Point: 303.2°C at 760 mmHg
• Flash Point: 151.4°C
• PSA: 57.53000
• Density: 1.027g/cm³
• LogP: 1.79240
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 174.125594432
• Heavy Atom Count: 12
• Complexity: 123

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(CC(=O)O)O

Technology Process of 3-Hydroxynonanoic acid

There total 9 articles about 3-Hydroxynonanoic 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: 86.0%

Ricinoleic acid (141-22-0,27925-02-6,7431-95-0,84799-84-8) → azelaic acid (123-99-9,26776-28-3) + β-hydroxynonanoic acid (33796-87-1,45023-83-4,88930-09-0,40165-87-5)

Guidance literature:

With oxygen; ozone; In water; acetone; at 0 ℃; Flow reactor;

DOI:10.1039/d0gc04021e

Reference yield: 84.0%

(Z)-12-hydroxyoctadec-9-enoic acid (81212-19-3,27925-02-6,7431-95-0,84799-84-8) → azelaic acid (123-99-9,26776-28-3) + β-hydroxynonanoic acid (33796-87-1,45023-83-4,88930-09-0,40165-87-5) + 12-hydroxy-9,10-epoxyoctadecanoic acid (47244-76-8,118201-32-4)

Guidance literature:

With cetylpyridinium peroxotungstophosphate; dihydrogen peroxide; In water; at 80 ℃; for 1h;

DOI:10.1007/s11172-006-0047-z

Reference yield: 60.8%

Ricinoleic acid (141-22-0,27925-02-6,7431-95-0,84799-84-8) → azelaic acid (123-99-9,26776-28-3) + (R)-3-hydroxynonanoic acid (33796-87-1)

Guidance literature:

With phosphotungstic acid; dihydrogen peroxide; cetylpyridinium bromide; In water; at 85 ℃; for 5h; Green chemistry;

DOI:10.1007/s11746-012-2134-7

upstream raw materials:

Ricinoleic acid

ozone

(+)-Δ³-carene

trans-2-cyanocyclohexanol

Downstream raw materials:

N-((3R)-3-hydroxynonanoyl)-N-Me-L-Leu-L-allo-Ile-L-Ser(Bn)-OAllyl

2-nonenoic acid