2,4-Dibromopyridine - ≥97% , CAS No.58530-53-3

CAS: 58530-53-3 Cat. No.: D124330 Fórmula: C₅H₃Br₂N Peso molecular: 236.89 Beilstein Registry Number: 20(5)5,435 Número CE: 663-373-4

GRADE & PURITY ≥97%

Synonyms

PS-7639 | AKOS002664731 | A8283 | MFCD01859720 | CL0012 | 2,4-dibromopyridine | 2,4-Dibromo-pyridine | SY017777 | AC-23012 | STK688513 | Pyridine, 2,4-dibromo- | SCHEMBL4614 | EN300-86277 | FT-0609993 | 2,4-Dibromopyridine, 97% | BCP22110 | W-203195 | AM2

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

PS-7639 | AKOS002664731 | A8283 | MFCD01859720 | CL0012 | 2,4-dibromopyridine | 2,4-Dibromo-pyridine | SY017777 | AC-23012 | STK688513 | Pyridine, 2,4-dibromo- | SCHEMBL4614 | EN300-86277 | FT-0609993 | 2,4-Dibromopyridine, 97% | BCP22110 | W-203195 | AM2

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

• Pubchem Sid: 488191505
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488191505
• Sorrisos canónicos: C1=CN=C(C=C1Br)Br
• IUPAC Name: 2,4-dibromopyridine
• InChIKey: PCMMSLVJMKQWMQ-UHFFFAOYSA-N
• INCHI: 1S/C5H3Br2N/c6-4-1-2-8-5(7)3-4/h1-3H
• SMILES isoméricas: C1=CN=C(C=C1Br)Br
• WGK Alemanha: 1
• Peso molecular: 236.89
• Beilstein: 20(5)5,435
• Reaxy-Rn: 108924
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=108924&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Halopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Polyhalopyridines
• Alternative Parents: 2-halopyridines Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - 2-halopyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as polyhalopyridines. These are organic compounds containing a pyridine ring substituted at two or more positions by a halogen 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

Propriedades químicas e físicas

• Solubilidade: Soluble in Methanol
• Sensibilidade: Air & Light sensitive.
• Ponto de inflamação (°F): >230 °F
• Ponto de inflamação (°C): >110 °C
• Ponto de ebulição (°C): 238 °C
• Ponto de fusão (°C): 38-40°C
• Peso molecular: 236.890 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 236.861 Da
• Monoisotopic Mass: 234.863 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 76.800
• 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