Span 80 - viscosity 1000-2000 mPa.s (20 °C) , CAS No.1338-43-8

CAS: 1338-43-8 Cat. No.: S431923 Fórmula: C₂₄H₄₄O₆ Peso molecular: 428.61 Beilstein Registry Number: 8172514 Número EC: 215-665-4

GRADE & PURITY viscosity 1000-2000 mPa.s (20 °C)

Synonyms

AKOS024431316 | CAS-1338-43-8 | INS NO.494 | Oleate de sorbitan [INN-French] | MO 33F | n-BUTYL HYDRAZINE OXALATE | Sorbitan mono-oletae | Kosteran O 1 | S0060 | Anhydrosorbitol monooleate | Sorbitani oleas [INN-Latin] | Armotan MO | Dianhydromannitol mon

Storage

Room temperature

Specifications

Sinónimos

AKOS024431316 | CAS-1338-43-8 | INS NO.494 | Oleate de sorbitan [INN-French] | MO 33F | n-BUTYL HYDRAZINE OXALATE | Sorbitan mono-oletae | Kosteran O 1 | S0060 | Anhydrosorbitol monooleate | Sorbitani oleas [INN-Latin] | Armotan MO | Dianhydromannitol mon

Especificaciones y pureza

viscosity 1000-2000 mPa.s (20 °C)

Condiciones de almacenamiento de almacenamiento

Room temperature

Nombres e identificadores

Pubchem Sid

504765094

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504765094

Sonrisas canónicas

CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@@H](O)[C@H]1OC[C@H](O)[C@H]1O

IUPAC Name

[(2R)-2-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] (Z)-octadec-9-enoate

InChIKey

NWGKJDSIEKMTRX-AAZCQSIUSA-N

INCHI

1S/C24H44O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)29-19-21(26)24-23(28)20(25)18-30-24/h9-10,20-21,23-26,28H,2-8,11-19H2,1H3/b10-9-/t20-,21+,23+,24+/m0/s1

Isómeros SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H]([C@@H]1[C@@H]([C@H](CO1)O)O)O

WGK Alemania

1

RTECS

WG2932400

Peso molecular

428.61

Beilstein

8172514

Reaxy-Rn

6346073

Taxonomic Classification

Taxonomy Tree

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

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

Objetivos asociados (humanos)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in ethanol at 50mg/mlMiscible with water, ethanol, isopropanol and ether. Insoluble in acetone.
• Sensibilidad: Moisture sensitive
• Índice de refracción: 1.48
• Punto de inflamación (°F): >230℉
• Punto de inflamación (°C): >110℃
• Peso molecular: 428.600 g/mol
• XLogP3: 6.000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 19
• Exact Mass: 428.314 Da
• Monoisotopic Mass: 428.314 Da
• Topological Polar Surface Area: 96.200 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 453.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1338-43-8, the molecular formula is C24H44O6, and the molecular weight is 428.61 g/mol. InChIKey NWGKJDSIEKMTRX-AAZCQSIUSA-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.