3-(Bromomethyl)pyridine Hydrobromide - ≥98%(T) , CAS No.4916-55-6

CAS: 4916-55-6 Cat. No.: B137612 Peso molecular: 252.94 Beilstein Registry Number: 20(5)5,537 Número EC: 628-885-4 PubChem CID: 12707037

GRADE & PURITY ≥98%(T)

Synonyms

3-(bromomethyl)pyridine hydrobromide salt | NSC338478 | NSC-338478 | 3-(BROMOMETHYL)PYRIDINE, HBR | 3-(bromomethyl)pyridine hydrogen bromide | Pyridine, 3-(bromomethyl)-, hydrobromide | FT-0623107 | 3-(Bromomethyl)pyridine hydrobromide, 97% | AC-2598 | AM

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

3-(Bromomethyl)pyridine hydrobromide is a halogenated heterocyclic building block.
3-(Bromomethyl)pyridine hydrobromide may be used in the preparation of ether ligands.

Specifications

Sinónimos

3-(bromomethyl)pyridine hydrobromide salt | NSC338478 | NSC-338478 | 3-(BROMOMETHYL)PYRIDINE, HBR | 3-(bromomethyl)pyridine hydrogen bromide | Pyridine, 3-(bromomethyl)-, hydrobromide | FT-0623107 | 3-(Bromomethyl)pyridine hydrobromide, 97% | AC-2598 | AM

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

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

Pureza

≥98%(T)

Nombres e identificadores

• Sonrisas canónicas: C1=CC(=CN=C1)CBr.Br
• IUPAC Name: 3-(bromomethyl)pyridine;hydrobromide
• InChIKey: FNHPUOJKUXFUKN-UHFFFAOYSA-N
• INCHI: 1S/C6H6BrN.BrH/c7-4-6-2-1-3-8-5-6;/h1-3,5H,4H2;1H
• Isómeros SMILES: C1=CC(=CN=C1)CBr.Br
• WGK Alemania: 3
• PubChem CID: 12707037
• Peso molecular: 252.94
• Beilstein: 20(5)5,537
• Reaxy-Rn: 6427534

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyridines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridines and derivatives
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives Hydrobromides Alkyl bromides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Hydrobromide - Organonitrogen compound - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyridines and derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of 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

• Punto de fusión (°C): 150-155°C
• Peso molecular: 252.930 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 252.892 Da
• Monoisotopic Mass: 250.895 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 65.500
• 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: 2

XLogP3