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

CAS: 110-38-3 Cat. No.: E101444 分子式: C₁₂H₂₄O₂ 分子量: 200.32 Beilstein Registry Number: 1762128 EC番号: 203-761-9

グレード＆純度 ≥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

仕様

同義語

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 | もっと見る

仕様と純度

≥99%

保管条件

Room temperature

入荷

Normal

純度

≥99%

名前と識別子

パブケム・シド

488180666

パブケム・シド・ウル

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

カノニカル・スマイル

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

異性体SMILES

CCCCCCCCCC(=O)OCC

WGKドイツ

2

RTECS

HD9420000

分子量

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
    • 分類 Fatty Acyls
      • Subclass Fatty acid esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 分類: 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
• 説明: 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

作用メカニズム

化学的性質と物理的性質

• 溶解度: Insoluble in water, glycerol, propylene glycol, soluble in ethanol, ether, and chloroform.
• 屈折率: 1.4248
• 引火点（°F）: 215.6 °F
• 引火点（°C）: 102℃
• 沸点（°C）: 243-245°C
• 融点（°C）: -20 °C
• 分子量: 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

よくある質問

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.