Ethyl decanoate - ≥99% , CAS No.110-38-3

CAS: 110-38-3 Cat. No.: E101444 Fórmula: C₁₂H₂₄O₂ Peso molecular: 200.32 Beilstein Registry Number: 1762128 Número EC: 203-761-9

CALIDAD & PUREZA ≥99%

Synonyms

ETHYL DECANOATE [FCC]|Capric acid ethyl ester|ETHYL CAPRATE [MI]|METHYL2-([4-HYDROXYDIHYDRO-2(3H)-ISOXAZOLYL]CARBONYL)BENZENECARBOXYLATE|Ethyl caprate|WE(2:0/10:0)|Ethyl caprinate|Ethyl n-decanoate|Ethyl decanoate (natural)|n-Capric acid ethyl ester|Decanoic acid, ethyl ester|ETHYL CAPRATE [INCI]|ETHYL DECANOATE|Decanoic acid-ethyl ester|ETHYL DECANOATE [FHFI]|Ethyl decylate|Capric acid, ethyl ester|Ethyl ester of Decanoic acid

Storage

Room temperature

Shipped In

Normal

Especificaciones

Sinónimos

ETHYL DECANOATE [FCC] | Capric acid ethyl ester | ETHYL CAPRATE [MI] | METHYL2-([4-HYDROXYDIHYDRO-2(3H)-ISOXAZOLYL]CARBONYL)BENZENECARBOXYLATE | Ethyl caprate | WE(2:0/10:0) | Ethyl caprinate | Ethyl n-decanoate | Ethyl decanoate (natural) | n-Capric acid ethyl ester | Decanoic acid, ethyl ester | ETHYL CAPRATE [INCI] | ETHYL DECANOATE | Show more

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

Pubchem Sid

488180666

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180666

Sonrisas canónicas

CCCCCCCCCC(=O)OCC

IUPAC Name

ethyl decanoate

InChIKey

RGXWDWUGBIJHDO-UHFFFAOYSA-N

INCHI

1S/C12H24O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h3-11H2,1-2H3

Isómeros SMILES

CCCCCCCCCC(=O)OCC

WGK Alemania

2

RTECS

HD9420000

Peso molecular

200.32

Beilstein

1762128

Reaxy-Rn

1762128

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1762128&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Fatty acid esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acid esters
• Alternative Parents: Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: 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 fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Insoluble in water, glycerol, propylene glycol, soluble in ethanol, ether, and chloroform.
• Índice de refracción: 1.4248
• Punto de inflamación (°F): 215.6 °F
• Punto de inflamación (°C): 102℃
• Punto de ebullición (°C): 243-245°C
• Punto de fusión (°C): -20 °C
• Peso molecular: 200.320 g/mol
• XLogP3: 4.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 200.178 Da
• Monoisotopic Mass: 200.178 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 132.000
• 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

Preguntas frecuentes

How should this product be stored?

Store at room temperature.

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

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 110-38-3, the molecular formula is C12H24O2, and the molecular weight is 200.32 g/mol. InChIKey RGXWDWUGBIJHDO-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.