4-Chloro-3-fluoropyridine - ≥95% , CAS No.2546-56-7

CAS: 2546-56-7 Cat. No.: C119649 Peso molecular: 131.54 Beilstein Registry Number: 1422750 Número EC: 629-495-7

GRADE & PURITY ≥95%

Synonyms

AM62391 | EN300-85351 | PYRIDINE, 4-CHLORO-3-FLUORO- | AB15511 | MFCD03453233 | 3-Fluoro-4-chloropyridine | 3-fluoro-4-chloro-pyridine | FT-0634353 | 4-chloro-3-fluoro-pyridin | BCP21109 | 4-chloro-3-fluoro pyridine | 4-Chloro-3-fluoropyridine, >=95.0% |

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

AM62391 | EN300-85351 | PYRIDINE, 4-CHLORO-3-FLUORO- | AB15511 | MFCD03453233 | 3-Fluoro-4-chloropyridine | 3-fluoro-4-chloro-pyridine | FT-0634353 | 4-chloro-3-fluoro-pyridin | BCP21109 | 4-chloro-3-fluoro pyridine | 4-Chloro-3-fluoropyridine, >=95.0% |

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 504762767
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504762767
• Sonrisas canónicas: C1=CN=CC(=C1Cl)F
• IUPAC Name: 4-chloro-3-fluoropyridine
• InChIKey: BEQUUSCRAKEKQM-UHFFFAOYSA-N
• INCHI: 1S/C5H3ClFN/c6-4-1-2-8-3-5(4)7/h1-3H
• Isómeros SMILES: C1=CN=CC(=C1Cl)F
• WGK Alemania: 3
• Peso molecular: 131.54
• Beilstein: 1422750
• Reaxy-Rn: 1422747
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1422747&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Polyhalopyridines
• Alternative Parents: Aryl fluorides Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - Aryl halide - Aryl fluoride - Aryl chloride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Air Sensitive,Heat Sensitive
• Índice de refracción: 1.5
• Punto de inflamación (°F): 82.4 °F
• Punto de inflamación (°C): 28°C
• Punto de ebullición (°C): 142.0-143.0°C
• Punto de fusión (°C): -27.0°C--24.0°C
• Peso molecular: 131.530 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 130.994 Da
• Monoisotopic Mass: 130.994 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 78.800
• 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