2-Methoxy-1,3-dioxolane - ≥98% , CAS No.19693-75-5

CAS: 19693-75-5 Cat. No.: M157786 Peso molecular: 104.11 Beilstein Registry Number: 103177 Número EC: 243-229-3

GRADE & PURITY ≥98%

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

Product Application
2-Methoxy-1,3-dioxolane was used in the synthesis of : [4,5-bis(hydroxymethyl)-1,3-dioxolan-2-yl]nucleosides, potential inhibitors of HIV diastereoisomeric cyclic acetals

Specifications

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

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

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504753403
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753403
• Sonrisas canónicas: COC1OCCO1
• IUPAC Name: 2-methoxy-1,3-dioxolane
• InChIKey: VRAYTNFBRROPJU-UHFFFAOYSA-N
• INCHI: 1S/C4H8O3/c1-5-4-6-2-3-7-4/h4H,2-3H2,1H3
• Isómeros SMILES: COC1OCCO1
• WGK Alemania: 3
• Peso molecular: 104.11
• Beilstein: 103177
• Reaxy-Rn: 103177
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=103177&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ortho esters

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ortho esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Ortho esters
• Alternative Parents: Carboxylic acid orthoesters 1,3-dioxolanes Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Ortho ester - Carboxylic acid orthoester - Meta-dioxolane - Orthocarboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as ortho esters. These are compounds having the general structure RC(OR')3 ( R' not H), or the structure C(OR')4 ( R' not H).
• 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

Propiedades químicas y físicas

• Sensibilidad: Moisture Sensitive
• Índice de refracción: 1.4
• Punto de inflamación (°F): 93.2 °F
• Punto de inflamación (°C): 34°C(lit.)
• Punto de ebullición (°C): 130°C
• Peso molecular: 104.100 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 104.047 Da
• Monoisotopic Mass: 104.047 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 48.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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