Ethyl Linoleate - technical grade, ≥65% , CAS No.544-35-4

CAS: 544-35-4 Cat. No.: E136660 Fórmula: C₂₀H₃₆O₂ Peso molecular: 308.51 Beilstein Registry Number: 2(4)1757 Número EC: 208-868-4

GRADE & PURITY Technical grade, ≥65%

Synonyms

ETHYL LINOLEATE [MI] | cis-9,cis-12-Octadecadienoic acid ethyl ester | SCHEMBL81540 | SR-01000946817 | L0055 | D01590 | Fmoc-(S)-3-Amino-3-(2-naphthyl)-propionicacid | NSC 50447 | Ethyl (9Z,12Z)-9,12-octadecadienoate # | ethyl linoleate-9,10,12,13-d4 | CH

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Sinónimos

ETHYL LINOLEATE [MI] | cis-9,cis-12-Octadecadienoic acid ethyl ester | SCHEMBL81540 | SR-01000946817 | L0055 | D01590 | Fmoc-(S)-3-Amino-3-(2-naphthyl)-propionicacid | NSC 50447 | Ethyl (9Z,12Z)-9,12-octadecadienoate # | ethyl linoleate-9,10,12,13-d4 | CH

Especificaciones y pureza

technical grade, ≥65%

Mecanismos bioquímicos y fisiológicos

Ethyl linoleate may be used as a reference material in assays that quantify fatty acid ethyl esters (FAEEs) for detection of alcohol abuse. Linoleic acid ethyl ester (Ethyl linoleate) may be used and studied as an acetylcholinesterase (AChE) inhibitor. Et

Condiciones de almacenamiento de almacenamiento

Protected from light,Room temperature

Enviado en

Normal

Grado

Grado técnico

Pureza

≥65%

Nombres e identificadores

Pubchem Sid

488195253

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488195253

Sonrisas canónicas

CCCCCC=CCC=CCCCCCCCC(=O)OCC

IUPAC Name

ethyl (9Z,12Z)-octadeca-9,12-dienoate

InChIKey

FMMOOAYVCKXGMF-MURFETPASA-N

INCHI

1S/C20H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h8-9,11-12H,3-7,10,13-19H2,1-2H3/b9-8-,12-11-

Isómeros SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC

WGK Alemania

1

RTECS

RG2185000

Peso molecular

308.51

Beilstein

2(4)1757

Reaxy-Rn

1727826

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1727826&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Lineolic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Lineolic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Lineolic acids and derivatives
• Alternative Parents: Fatty acid esters Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Octadecanoid - Fatty acid ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as lineolic acids and derivatives. These are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions.
• External Descriptors: long-chain fatty acid ethyl ester

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Light Sensitive,Air Sensitive
• Índice de refracción: 1.46
• Punto de inflamación (°F): 235.4 °F
• Punto de inflamación (°C): 113 °C
• Punto de ebullición (°C): 193°C/6mmHg
• Peso molecular: 308.500 g/mol
• XLogP3: 7.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 16
• Exact Mass: 308.272 Da
• Monoisotopic Mass: 308.272 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 292.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥65% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What does technical grade mean?

technical grade indicates that the material has been processed and tested for specialty industrial processing. Specifications focus on the impurities that affect performance in that application — for example, metal content for electronics, particle size for batteries, refractive index for optics, or moisture content for moisture-sensitive processes.

How should this product be stored?

Store at room temperature, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 544-35-4, the molecular formula is C20H36O2, and the molecular weight is 308.51 g/mol. InChIKey FMMOOAYVCKXGMF-MURFETPASA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.