Arachidyl dodecanoate , CAS No.36617-18-2

CAS: 36617-18-2 Cat. No.: A353384 Fórmula: C₃₂H₆₄O₂ Peso molecular: 480.85

Synonyms

Icosyl Dodecanoate | ARACHIDYLLAURATE | Arachidyl laureate | Dodecanoic acid eicosyl ester | LAURIC ACID ARACHIDYL ESTER | UNII-H8ECE8WM2L | WE(20:0/12:0) | eicosanyl dodecanoate | H8ECE8WM2L | FT-0639328 | Arachidyl dodecanoate, >=99% | N-Eicosyl N-dodec

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Arachidyl dodecanoate is a laurate medium-chain unsaturated fatty acid ester compound that may be used as a reference in the analysis of wax esters of lauric acid.

Specifications

Sinónimos

Icosyl Dodecanoate | ARACHIDYLLAURATE | Arachidyl laureate | Dodecanoic acid eicosyl ester | LAURIC ACID ARACHIDYL ESTER | UNII-H8ECE8WM2L | WE(20:0/12:0) | eicosanyl dodecanoate | H8ECE8WM2L | FT-0639328 | Arachidyl dodecanoate, >=99% | N-Eicosyl N-dodec

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Nomes e identificadores

• Sorrisos canónicos: CCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
• IUPAC Name: icosyl dodecanoate
• InChIKey: GTUGKPSGIYCKEQ-UHFFFAOYSA-N
• INCHI: 1S/C32H64O2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-29-31-34-32(33)30-28-26-24-22-12-10-8-6-4-2/h3-31H2,1-2H3
• SMILES isoméricas: CCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
• Peso molecular: 480.85
• Reaxy-Rn: 1888705
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1888705&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty acid esters
        • Level5 Wax esters
          • Level6 Wax monoesters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Wax esters
• Direct Parent: Wax monoesters
• Alternative Parents: Fatty alcohol esters Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Wax monoester skeleton - Fatty alcohol 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
• Descrição: This compound belongs to the class of organic compounds known as wax monoesters. These are waxes bearing an ester group at exactly one position.
• External Descriptors: Wax monoesters

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

Propriedades químicas e físicas

• Peso molecular: 480.800 g/mol
• XLogP3: 15.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 30
• Exact Mass: 480.491 Da
• Monoisotopic Mass: 480.491 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 379.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 36617-18-2, the molecular formula is C32H64O2, and the molecular weight is 480.85 g/mol. InChIKey GTUGKPSGIYCKEQ-UHFFFAOYSA-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.