Span® 80 - nonionic surfactant , CAS No.1338-43-8

CAS: 1338-43-8 Cat. No.: S110839 Fórmula: C₂₄H₄₄O₆ Peso molecular: 428.61 Beilstein Registry Number: 8172514 Número EC: 215-665-4

GRADE & PURITY nonionic surfactant

Synonyms

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 monooleate | Sorbon S 80 | Span(R) 80, viscosity

Storage

Room temperature

Shipped In

Normal

Descripción general

Span 80 is a biodegradable surfactant based on a natural fatty acid (oleic acid) and the sugar alcohol sorbitol. This sorbitan ester is highly effective at forming O/W emulsions, particularly when used in combination with its polyethoxylated derivative, Tween 80. Chemical group：Nonionic Surfactants - Sorbitan Esters and Ethoxylated Sorbitan Esters Fatty acid composition: Oleic acid (C18:1) ≤ 60%; balance primarily linoleic (C18:2), linolenic (C18:3) and palmitic (C16:0) acids. 
Span® 80 has been used in a study to assess transfersomes as a transdermal delivery system for sertraline. It has also been used in a study to investigate the dominant factors affecting the stability of nanoemulsions through the use of artificial neural networks (ANNs).

Specifications

Sinónimos

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 monooleate | Sorbon S 80 | Span(R) 80, viscosity

Especificaciones y pureza

nonionic surfactant

Información jurídica

Span is a registered trademark of Croda International PLC

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Nombres e identificadores

Pubchem Sid

488196427

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488196427

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.

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 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.