Octyl α-D-glucopyranoside - ≥98% , CAS No.29781-80-4

CAS: 29781-80-4 Cat. No.: O120925 Peso molecular: 292.37 Beilstein Registry Number: 4232620

GRADE & PURITY ≥98%

Synonyms

HY-137313 | Octyl alpha-D-glucopyranoside | n-Octyl alpha-glucoside | .ALPHA.-1-N-OCTYL-D-GLUCOPYRANOSIDE | MFCD00864906 | AMY41910 | Octyl alpha-D-glucopyranoside, >=98.0% (TLC) | Aluminum hydroxide (Al(OH)3), mixt. with magnesium hydroxide (Mg(OH)2) and

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

It has been used in a study to assess mesogenic structures with interdigitizing alkyl chains, and also been used in a study to investigate a recirculation procedure involving water removal by product crystallization.

Specifications

Sinónimos

HY-137313 | Octyl alpha-D-glucopyranoside | n-Octyl alpha-glucoside | .ALPHA.-1-N-OCTYL-D-GLUCOPYRANOSIDE | MFCD00864906 | AMY41910 | Octyl alpha-D-glucopyranoside, >=98.0% (TLC) | Aluminum hydroxide (Al(OH)3), mixt. with magnesium hydroxide (Mg(OH)2) and

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CCCCCCCCOC1C(C(C(C(O1)CO)O)O)O
• IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol
• InChIKey: HEGSGKPQLMEBJL-RGDJUOJXSA-N
• INCHI: 1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14+/m1/s1
• Isómeros SMILES: CCCCCCCCO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
• WGK Alemania: 3
• Peso molecular: 292.37
• Beilstein: 4232620
• Reaxy-Rn: 25301480
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=25301480&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acyl glycosides
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acyl glycosides of mono- and disaccharides
• Alternative Parents: Hexoses Alkyl glycosides O-glycosyl compounds Oxanes Secondary alcohols Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Fatty acyl glycoside of mono- or disaccharide - Alkyl glycoside - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Monosaccharide - Oxane - Secondary alcohol - Acetal - Organoheterocyclic compound - Oxacycle - Polyol - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. These are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol.
• External Descriptors: alpha-D-glucoside

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

• Peso molecular: 292.370 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 292.189 Da
• Monoisotopic Mass: 292.189 Da
• Topological Polar Surface Area: 99.400 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 250.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 5
• 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