Diethylmethoxyborane - 1.0 M in THF , CAS No.7397-46-8

CAS: 7397-46-8 Cat. No.: D164492 Peso molecular: 99.97 Número EC: 425-380-9

GRADE & PURITY 1.0 M in THF

Synonyms

Diethylmethoxyborane, 97% | Methyl diethylborinate | CCG-355662 | Methyl diethylborinate # | methyl esterb,b-diethyl-borinic acid | Borinic acid, diethyl-, methyl ester | AKOS015915365 | EN300-102558 | diethyl methoxyborane | Diethylmethoxyborane | diethy

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

Diethylmethoxyborane, 97% | Methyl diethylborinate | CCG-355662 | Methyl diethylborinate # | methyl esterb, b-diethyl-borinic acid | Borinic acid, diethyl-, methyl ester | AKOS015915365 | EN300-102558 | diethyl methoxyborane | Diethylmethoxyborane | diethy

Especificaciones y pureza

1.0 M in THF

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Nombres e identificadores

• Sonrisas canónicas: B(CC)(CC)OC
• IUPAC Name: diethyl(methoxy)borane
• InChIKey: FESAXEDIWWXCNG-UHFFFAOYSA-N
• INCHI: 1S/C5H13BO/c1-4-6(5-2)7-3/h4-5H2,1-3H3
• Isómeros SMILES: B(CC)(CC)OC
• WGK Alemania: 2
• Peso molecular: 99.97
• Reaxy-Rn: 2231225
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2231225&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Borinic acid derivatives
      • Subclass Borinic acid esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Borinic acid derivatives
• Subclass: Borinic acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Borinic acid esters
• Alternative Parents: Organic metalloid salts Dialkylboranes Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Borinic acid ester - Dialkylborane - Organic metalloid salt - Organic oxygen compound - Alkylborane - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoboron compound - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as borinic acid esters. These are compounds comprising the boronic acid ester functional group RB(R')OR'' (R,R',R''=organyl; X= any O,N,Hal residue).
• 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
• Punto de inflamación (°F): 19.4 °F
• Punto de inflamación (°C): -7 °C
• Peso molecular: 99.970 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 100.106 Da
• Monoisotopic Mass: 100.106 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 35.100
• 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