9-Azabicyclo[3.3.1]nonane n-oxyl - ≥98% , CAS No.31785-68-9

CAS: 31785-68-9 Cat. No.: A588704 Peso molecular: 141.21 Número EC: 803-697-7

GRADE & PURITY ≥98%

Synonyms

ABNO | F18215 | 9-azabicyclo[3.3.1]nonane n-oxyl | 9-AZABICYCLO[3.3.1]NONAN-9-OL | 9-azabicyclo[3.3.1]nonane-N-oxyl | 9-AZABICYCLO[3.3.1]NON-9-YLOXY | SZAKAAGHPLUEPM-UHFFFAOYSA-N | SCHEMBL16264920 | 9-hydroxy-9-azabicyclo[3.3.1]nonane | SY322958 | LS-1348

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

Product Describtion:

9-azabicyclic [3.3.1] nonane N-oxy (ABNO) is a stable nitrogen oxygen radical without hindrance. It can efficiently catalyze the oxidation of alcohols into corresponding carbonyl compounds. ABNO can be combined with (MeObpy)CuI(OTf) (MeObpy =4,4 '-dimethoxy-2,2' -bipyridine) to form a catalytic system for aerobic oxidation of all alcohols.

Product Application:

9-azabicyclic [3.3.1] nonane n-oxo (ABNO) can be used for aerobic oxidation of alcohols. Copper catalyzed green oxidation of alcohol under aerobic conditions.

Specifications

Sinónimos

ABNO | F18215 | 9-azabicyclo[3.3.1]nonane n-oxyl | 9-AZABICYCLO[3.3.1]NONAN-9-OL | 9-azabicyclo[3.3.1]nonane-N-oxyl | 9-AZABICYCLO[3.3.1]NON-9-YLOXY | SZAKAAGHPLUEPM-UHFFFAOYSA-N | SCHEMBL16264920 | 9-hydroxy-9-azabicyclo[3.3.1]nonane | SY322958 | LS-1348

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: 504771689
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504771689
• Sonrisas canónicas: C1CC2CCCC(C1)N2O
• IUPAC Name: 9-hydroxy-9-azabicyclo[3.3.1]nonane
• InChIKey: WUXMSJQQHBZNIK-UHFFFAOYSA-N
• INCHI: 1S/C8H15NO/c10-9-7-3-1-4-8(9)6-2-5-7/h7-8,10H,1-6H2
• Isómeros SMILES: C1CC2CCCC(C1)N2O
• CAS alternativo: 31785-68-9
• Peso molecular: 141.21
• Reaxy-Rn: 1617642
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1617642&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Piperidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Piperidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Piperidines
• Alternative Parents: N-organohydroxylamines Azacyclic compounds Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Piperidine - Azacycle - N-organohydroxylamine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
• 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: air and moisture sensitive
• Punto de fusión (°C): 65-70℃
• Peso molecular: 141.210 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 141.115 Da
• Monoisotopic Mass: 141.115 Da
• Topological Polar Surface Area: 23.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 104.000
• 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