tributyl(3,4-dihydro-2H-pyran-6-yl)stannane - ≥95% , CAS No.109669-45-6

CAS: 109669-45-6 Cat. No.: T1023723 Peso molecular: 373.16 Número EC: 663-424-0 PubChem CID: 4216837

GRADE & PURITY ≥95%

Storage

Room temperature

Specifications

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Room temperature

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CCCC[Sn](CCCC)(CCCC)C1=CCCCO1
• IUPAC Name: tributyl(3,4-dihydro-2H-pyran-6-yl)stannane
• InChIKey: ZQMLPLBDZBCQCV-UHFFFAOYSA-N
• INCHI: 1S/C5H7O.3C4H9.Sn/c1-2-4-6-5-3-1;3*1-3-4-2;/h2H,1,3,5H2;3*1,3-4H2,2H3
• Isómeros SMILES: CCCC[Sn](CCCC)(CCCC)C1=CCCCO1
• WGK Alemania: 3
• PubChem CID: 4216837
• Peso molecular: 373.16

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ketene acetals

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ketene acetals
• Intermediate Tree Nodes: Not available
• Direct Parent: Ketene acetals
• Alternative Parents: Trialkyltins Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Trialkyltin - Ketene acetal or derivatives - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organotin compound - Organometallic compound - Organic post-transition metal moeity - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as ketene acetals. These are organic compounds comprising the ketene acetal functional group, with the general structure XC(Y)=C(R3)R4 (R1,R2=H, alkyl, aryl; X,Y=any hetero atom).
• 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

• Punto de inflamación (°F): >230 °F
• Punto de inflamación (°C): >110 °C
• Peso molecular: 373.200 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 374.163 Da
• Monoisotopic Mass: 374.163 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 238.000
• 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

XLogP3