Stearyl arachidate - ≥99% , CAS No.22432-79-7

CAS: 22432-79-7 Cat. No.: S352339 Formule: C₃₈H₇₆O₂ Poids moléculaire: 565.01 PubChem CID: 89710

GRADE & PURITY ≥99%

Synonyms

LMFA07010057 | HY-W127418 | Arachidic acid stearyl ester | Octadecyl eicosanoate | Heptadecyl arachidate | STEARYLARACHIDATE | Eicosanoic acid,octadecyl ester | Octadecyl icosanoate # | J-014713 | stearyl eicosanoate | DTXSID0066797 | EINECS 244-994-6 | Q

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonymes

LMFA07010057 | HY-W127418 | Arachidic acid stearyl ester | Octadecyl eicosanoate | Heptadecyl arachidate | STEARYLARACHIDATE | Eicosanoic acid,octadecyl ester | Octadecyl icosanoate # | J-014713 | stearyl eicosanoate | DTXSID0066797 | EINECS 244-994-6 | Q

Spécifications et pureté

≥99%

Conditions de stockage de stockage

Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥99%

Noms et identifiants

Pubchem Sid

504755997

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755997

Sourires canoniques

CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCC

IUPAC Name

octadecyl icosanoate

InChIKey

XPRSWAIUFMEQLF-UHFFFAOYSA-N

INCHI

1S/C38H76O2/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38(39)40-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h3-37H2,1-2H3

Isomères SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCC

PubChem CID

89710

Poids moléculaire

565.01

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty acid esters
        • Level5 Wax esters
          • Level6 Wax monoesters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Wax esters
• Direct Parent: Wax monoesters
• Alternative Parents: Fatty alcohol esters Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Wax monoester skeleton - Fatty alcohol 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
• Description: This compound belongs to the class of organic compounds known as wax monoesters. These are waxes bearing an ester group at exactly one position.
• External Descriptors: a wax 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

Propriétés chimiques et physiques

• Poids moléculaire: 565.000 g/mol
• XLogP3: 18.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 36
• Exact Mass: 564.585 Da
• Monoisotopic Mass: 564.585 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 40
• Formal Charge: 0
• Complexity: 460.000
• 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