Ethyl ricinoleate - ≥80% , CAS No.55066-53-0

CAS: 55066-53-0 Cat. No.: E138988 Fórmula: C₂₀H₃₈O₃ Peso molecular: 326.51 Beilstein Registry Number: 3(4)1029 Número EC: 259-462-9

GRADE & PURITY ≥80%

Synonyms

9-Octadecenoic acid, 12-hydroxy-, ethyl ester, (9Z,12R)- | Q27278944 | EINECS 259-462-9 | Ethyl (R)-12-hydroxyoleate | 9-Octadecenoic acid, 12-hydroxy-, ethyl ester, (R-(Z))- | RICINOLEATE D'ETHYLE | ethyl (Z,12R)-12-hydroxyoctadec-9-enoate | HY-W013222 |

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

9-Octadecenoic acid, 12-hydroxy-, ethyl ester, (9Z,12R)- | Q27278944 | EINECS 259-462-9 | Ethyl (R)-12-hydroxyoleate | 9-Octadecenoic acid, 12-hydroxy-, ethyl ester, (R-(Z))- | RICINOLEATE D'ETHYLE | ethyl (Z,12R)-12-hydroxyoctadec-9-enoate | HY-W013222 |

Especificaciones y pureza

≥80%

Condiciones de almacenamiento de almacenamiento

Argon charged,Room temperature

Enviado en

Normal

Pureza

≥80%

Nombres e identificadores

• Pubchem Sid: 488195786
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488195786
• Sonrisas canónicas: CCCCCCC(CC=CCCCCCCCC(=O)OCC)O
• IUPAC Name: ethyl (Z,12R)-12-hydroxyoctadec-9-enoate
• InChIKey: AZXVZUBIFYQWJK-KWRJMZDGSA-N
• INCHI: 1S/C20H38O3/c1-3-5-6-13-16-19(21)17-14-11-9-7-8-10-12-15-18-20(22)23-4-2/h11,14,19,21H,3-10,12-13,15-18H2,1-2H3/b14-11-/t19-/m1/s1
• Isómeros SMILES: CCCCCC[C@H](C/C=C\CCCCCCCC(=O)OCC)O
• Peso molecular: 326.51
• Beilstein: 3(4)1029
• Reaxy-Rn: 1728752
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1728752&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Fatty acid esters Secondary alcohols Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Fatty acid ester - Secondary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Air Sensitive
• Punto de ebullición (°C): 258 °C/13 mmHg
• Peso molecular: 326.500 g/mol
• XLogP3: 6.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 17
• Exact Mass: 326.282 Da
• Monoisotopic Mass: 326.282 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 287.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥80% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 55066-53-0, the molecular formula is C20H38O3, and the molecular weight is 326.51 g/mol. InChIKey AZXVZUBIFYQWJK-KWRJMZDGSA-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.