Nonanoato di etile - ≥95%(GC) , CAS No.123-29-5

CAS: 123-29-5 Cat. No.: E156541 Formula: C₁₁H₂₂O₂ Peso molecolare: 186.3 Beilstein Registry Number: 1759170 Numero EC: 204-615-7

QUALITÀ & PUREZZA ≥95%(GC)

Synonyms

Nonanoic acid, ethyl ester|Ethyl nonylate; Ethyl pelargonate|ETHYL NONANOATE|Ethyl nonylate|ethylnonanoate|Ethyl nonanoate (natural)|ETHYL NONANOATE [FCC]|Ethyl pelargonate|Nonanoic acid-ethyl ester|Nonylic Acid Ethyl Ester|ETHYL NONANOATE [FHFI]|Nonanoic acid ethyl ester|Wine ether|ETHYL PELARGONATE [INCI]|ETHYL PELARGONATE [MI]|Pelargonic Acid Ethyl Ester

Storage

Room temperature

Shipped In

Normale

Panoramica

L'etilnonanoato viene separato e quantificato da cachaca, rum e whisky mediante spettrometria gascromatografica a iniezione diretta[1]. Viene utilizzato come standard interno per monitorare l'integrità e l'efficienza dell'estrazione delle fibre di microestrazione in fase solida.

Specifiche

Sinonimi

Nonanoic acid, ethyl ester | Ethyl nonylate; Ethyl pelargonate | ETHYL NONANOATE | Ethyl nonylate | ethylnonanoate | Ethyl nonanoate (natural) | ETHYL NONANOATE [FCC] | Ethyl pelargonate | Nonanoic acid-ethyl ester | Nonylic Acid Ethyl Ester | ETHYL NONANOATE [FHFI] | Nonanoic acid ethyl ester | Wine ether | ETHYL PELARGONATE [INCI] | ET Mostra altro

Specifiche e purezza

≥95%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normale

Purezza

≥95%(GC)

Nomi e identificatori

Pubchem Sid

488183149

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488183149

Sorrisi canonici

CCCCCCCCC(=O)OCC

IUPAC Name

ethyl nonanoate

InChIKey

BYEVBITUADOIGY-UHFFFAOYSA-N

INCHI

1S/C11H22O2/c1-3-5-6-7-8-9-10-11(12)13-4-2/h3-10H2,1-2H3

Isomeri SMILES

CCCCCCCCC(=O)OCC

WGK Germania

2

RTECS

RA6845000

Peso molecolare

186.3

Beilstein

1759170

Reaxy-Rn

1759169

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1759169&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: 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
• Descrizione: 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: 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.422
• Punto di infiammabilità (°F): 201.2 °F
• Punto di infiammabilità (°C): 104°C
• Punto di ebollizione (°C): 119 °C/23 mmHg
• Punto di fusione (°C): -44 °C
• Peso molecolare: 186.290 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 186.162 Da
• Monoisotopic Mass: 186.162 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 121.000
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥95% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 123-29-5, the molecular formula is C11H22O2, and the molecular weight is 186.3 g/mol. InChIKey BYEVBITUADOIGY-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.