Ethyl β-D-Glucopyranoside - Moligand™,≥97% , CAS No.3198-49-0

CAS: 3198-49-0 Cat. No.: E697674 Molecular Weight: 208.21 EC Number: 250-112-0

GRADE & PURITY Moligand™, ≥97%

Synonyms

(2R,3R,4S,5S,6R)-2-Ethoxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol | Ethyl D-glucopyranoside | Ethyl β-D-glucopyranoside | Ethyl glucoside

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

(2R, 3R, 4S, 5S, 6R)-2-Ethoxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3, 4, 5-triol | Ethyl D-glucopyranoside | Ethyl β-D-glucopyranoside | Ethyl glucoside

Specifications & Purity

Moligand™, ≥97%

Storage

Protected from light, Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCOC1C(C(C(C(O1)CO)O)O)O
• IUPAC Name: (2R,3R,4S,5S,6R)-2-ethoxy-6-(hydroxymethyl)oxane-3,4,5-triol
• InChIKey: WYUFTYLVLQZQNH-JAJWTYFOSA-N
• INCHI: 1S/C8H16O6/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8/h4-12H,2-3H2,1H3/t4-,5-,6+,7-,8-/m1/s1
• Isomeric SMILES: CCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
• Alternate CAS: 30285-48-4,3198-49-0
• MeSH Entry Terms: alpha-ethylglucoside;ethyl glucoside;ethyl glucoside hexadecanoate, (D)-isomer;ethyl glucoside, (alpha-D)-isomer;ethyl glucoside, (beta-D)-isomer;ethyl glucoside, (D)-isomer
• Molecular Weight: 208.21
• Reaxy-Rn: 34589062
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=34589062&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Glycosyl compounds
          • Level6 O-glycosyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Glycosyl compounds
• Direct Parent: O-glycosyl compounds
• Alternative Parents: Hexoses Oxanes Secondary alcohols Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Hexose monosaccharide - O-glycosyl compound - Oxane - Monosaccharide - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Polyol - Acetal - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond.
• 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

Chemical and Physical Properties

• Solubility: heat sensitive;Moisture sensitive
• Melt Point(°C): 81 °C
• Molecular Weight: 208.210 g/mol
• XLogP3: -1.800
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 208.095 Da
• Monoisotopic Mass: 208.095 Da
• Topological Polar Surface Area: 99.400 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 175.000
• 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

References

1. Jinghua Wang, Jiangang Wang, Hongyou Cui.  (2025)  Formylation-mediated pretreatment: Enabling high-yield production of methyl levulinate from cellulose at high substrate loading.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.167667]