6-O-Stearoyl-L-ascorbic Acid - ≥95%(T) , CAS No.10605-09-1

CAS: 10605-09-1 Cat. No.: O159941 Fórmula: C₂₄H₄₂O₇ Peso molecular: 442.59

GRADE & PURITY ≥95%(T)

Synonyms

L-Stearoyl-6-ascorbic Acid | BRD-A87673115-001-01-7 | NSC759841 | 6-O-Stearoyl-L-ascorbic Acid | AKOS005145756 | L-Ascorbyl-6-stearate | L-ASCORBYL 6-OCTADECANOATE | (S)-2-((R)-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl)-2-hydroxyethyl stearate | 6-Ascorby

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

L-Stearoyl-6-ascorbic Acid | BRD-A87673115-001-01-7 | NSC759841 | 6-O-Stearoyl-L-ascorbic Acid | AKOS005145756 | L-Ascorbyl-6-stearate | L-ASCORBYL 6-OCTADECANOATE | (S)-2-((R)-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl)-2-hydroxyethyl stearate | 6-Ascorby

Especificações e pureza

≥95%(T)

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥95%(T)

Nomes e identificadores

• Pubchem Sid: 488201716
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488201716
• Sorrisos canónicos: CCCCCCCCCCCCCCCCCC(=O)OCC(C1C(=C(C(=O)O1)O)O)O
• IUPAC Name: [(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] octadecanoate
• InChIKey: LITUBCVUXPBCGA-WMZHIEFXSA-N
• INCHI: 1S/C24H42O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(26)30-18-19(25)23-21(27)22(28)24(29)31-23/h19,23,25,27-28H,2-18H2,1H3/t19-,23+/m0/s1
• SMILES isoméricas: CCCCCCCCCCCCCCCCCC(=O)OC[C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O
• RTECS: CI7671310
• Peso molecular: 442.59
• Reaxy-Rn: 354832
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=354832&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: Dicarboxylic acids and derivatives Butenolides Vinylogous acids Enoate esters Secondary alcohols Lactones Enediols Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Fatty acid ester - 2-furanone - Dicarboxylic acid or derivatives - Dihydrofuran - Enoate ester - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Enediol - Lactone - Secondary alcohol - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound
• Descrição: 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: 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

Mecanismos de ação

Propriedades químicas e físicas

• Índice de refração: 21°
• Rotação específica [α]: 21° (C=1,EtOH)
• Ponto de fusão (°C): 117 °C
• Peso molecular: 442.600 g/mol
• XLogP3: 7.300
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 20
• Exact Mass: 442.293 Da
• Monoisotopic Mass: 442.293 Da
• Topological Polar Surface Area: 113.000 Ų
• Heavy Atom Count: 31
• Formal Charge: 0
• Complexity: 544.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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

Perguntas frequentes

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 10605-09-1, the molecular formula is C24H42O7, and the molecular weight is 442.59 g/mol. InChIKey LITUBCVUXPBCGA-WMZHIEFXSA-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.