≥95%, 100 μg/ml in ethanol for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
(+/-)-9-HETE is a metabolism of free radical-mediated arachidonic acid oxidation forms 9-HETE. It is observed in placque and is found to be a major product of lipid peroxidation in atherosclerotis.
| Canonical Smiles | CCCCCC=CCC=CCC(C=CC=CCCCC(=O)O)O |
|---|---|
| IUPAC Name | (5Z,7E,11Z,14Z)-9-hydroxyicosa-5,7,11,14-tetraenoic acid |
| InChIKey | KATOYYZUTNAWSA-OIZRIKEUSA-N |
| INCHI | 1S/C20H32O3/c1-2-3-4-5-6-7-8-10-13-16-19(21)17-14-11-9-12-15-18-20(22)23/h6-7,9-11,13-14,17,19,21H,2-5,8,12,15-16,18H2,1H3,(H,22,23)/b7-6-,11-9-,13-10-,17-14+ |
| Isomeric SMILES | CCCCC/C=C\C/C=C\CC(/C=C/C=C\CCCC(=O)O)O |
| WGK Germany | 3 |
| Alternate CAS | 70968-92-2 |
| Molecular Weight | 320.47 |
| Reaxy-Rn | 34893643 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34893643&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Class | Fatty Acyls |
| Subclass | Eicosanoids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Hydroxyeicosatetraenoic acids |
| Alternative Parents | Long-chain fatty acids Hydroxy fatty acids Unsaturated fatty acids Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Hydroxyeicosatetraenoic acid - Long-chain fatty acid - Hydroxy fatty acid - Fatty acid - Unsaturated fatty acid - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as hydroxyeicosatetraenoic acids. These are eicosanoic acids with an attached hydroxyl group and four CC double bonds. |
| External Descriptors | Hydroxy/hydroperoxyeicosatetraenoic acids |
| Solubility | 0.1 M Na2CO3: 2 mg/ml |
|---|---|
| Refractive Index | n20D1.51 |
| Flash Point(°F) | 55.4°F |
| Flash Point(°C) | 13°C |
| Boil Point(°C) | 78° C |
| Melt Point(°C) | -114°C |
| Molecular Weight | 320.500 g/mol |
| XLogP3 | 5.200 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 14 |
| Exact Mass | 320.235 Da |
| Monoisotopic Mass | 320.235 Da |
| Topological Polar Surface Area | 57.500 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 392.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 4 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 4 |
| Covalently-Bonded Unit Count | 1 |
