Bis(neopentyl glycolato)diboron - ≥98% , CAS No.201733-56-4

CAS: 201733-56-4 Cat. No.: B119771 Peso molecular: 225.89 Beilstein Registry Number: 8839038 Número EC: 639-407-9

GRADE & PURITY ≥98%

Synonyms

AS-2636 | 5,5,5',5'-tetramethyl-[2,2']bi[1,3,2]dioxaborinanyl | BIS(NEOPENTYL GLYCOLATO)DIBORANE | bis-(neopentyl glycolato)diborane | EN300-200601 | 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane;5,5,5',5'-Tetramethyl-2,2'-bi(1

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

Reagent to prepare boronic acid esters

Specifications

Sinónimos

AS-2636 | 5, 5, 5', 5'-tetramethyl-[2, 2']bi[1, 3, 2]dioxaborinanyl | BIS(NEOPENTYL GLYCOLATO)DIBORANE | bis-(neopentyl glycolato)diborane | EN300-200601 | 2-(5, 5-dimethyl-1, 3, 2-dioxaborinan-2-yl)-5, 5-dimethyl-1, 3, 2-dioxaborinane;5, 5, 5', 5'-Tetramethyl-2, 2'-bi(1

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

• Sonrisas canónicas: B1(OCC(CO1)(C)C)B2OCC(CO2)(C)C
• IUPAC Name: 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane
• InChIKey: MDNDJMCSXOXBFZ-UHFFFAOYSA-N
• INCHI: 1S/C10H20B2O4/c1-9(2)5-13-11(14-6-9)12-15-7-10(3,4)8-16-12/h5-8H2,1-4H3
• Isómeros SMILES: B1(OCC(CO1)(C)C)B2OCC(CO2)(C)C
• WGK Alemania: 3
• Peso molecular: 225.89
• Beilstein: 8839038
• Reaxy-Rn: 8839038
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8839038&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Oxacyclic compounds

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Oxacyclic compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxacyclic compounds
• Alternative Parents: Organic metalloid salts Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxacycle - Organic metalloid salt - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as oxacyclic compounds. These are organic compounds containing an heterocycle with at least one oxygen atom linked to a ring carbon.
• 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

• Solubilidad: Insoluble in water; Soluble in Methanol
• Sensibilidad: moisture & Heat sensitive
• Punto de fusión (°C): 192°C
• Peso molecular: 225.900 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 226.155 Da
• Monoisotopic Mass: 226.155 Da
• Topological Polar Surface Area: 36.900 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 211.000
• 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