8-Ethoxycarbonyloctanol , CAS No.3639-34-7

CAS: 3639-34-7 Cat. No.: E340661 Summenformel: C₁₁H₂₂O₃ Molekulargewicht: 202.29

Synonyms

Ethyl 9-hydroxynonanoate | DTXSID70394221 | ethyl-9-hydroxynonanoate | 9-Hydroxy-nonanoic AcidEthyl Ester | SCHEMBL1896403 | MNWRYCGYJOYZEI-UHFFFAOYSA-N | AKOS030240284 | 8-ETHOXYCARBONYLOCTANOL | FT-0621532 | 8-ethoxycarbonyl-1-octanol

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

8-Ethoxycarbonyloctanol is a volatile hydroxy component of Albana wine.

Specifications

Synonyme

Ethyl 9-hydroxynonanoate | DTXSID70394221 | ethyl-9-hydroxynonanoate | 9-Hydroxy-nonanoic AcidEthyl Ester | SCHEMBL1896403 | MNWRYCGYJOYZEI-UHFFFAOYSA-N | AKOS030240284 | 8-ETHOXYCARBONYLOCTANOL | FT-0621532 | 8-ethoxycarbonyl-1-octanol

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

• Kanonisches Lächeln: CCOC(=O)CCCCCCCCO
• IUPAC Name: ethyl 9-hydroxynonanoate
• InChIKey: MNWRYCGYJOYZEI-UHFFFAOYSA-N
• INCHI: 1S/C11H22O3/c1-2-14-11(13)9-7-5-3-4-6-8-10-12/h12H,2-10H2,1H3
• Isomere SMILES: CCOC(=O)CCCCCCCCO
• Molekulargewicht: 202.29
• Reaxy-Rn: 1906969
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1906969&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Klasse Fatty Acyls
      • Subclass Fatty alcohols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Fatty acid esters Carboxylic acid esters Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Fatty acid ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.
• External Descriptors: Not available

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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in Chloroform
• Molekulargewicht: 202.290 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 202.157 Da
• Monoisotopic Mass: 202.157 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 134.000
• 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

Häufig gestellte Fragen

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 3639-34-7, the molecular formula is C11H22O3, and the molecular weight is 202.29 g/mol. InChIKey MNWRYCGYJOYZEI-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.

How should this product be stored?

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