3,5-Dichloro-2,6-difluoropyridine - ≥98% , CAS No.698-51-1

CAS: 698-51-1 Cat. No.: D186103 Peso molecular: 183.97 Número EC: 962-496-3

GRADE & PURITY ≥98%

Synonyms

C5HCl2F2N | MFCD03001157 | DS-5140 | A26077 | 1-Aminoindanehydrochloride | 3,5-dichloro-2,6-difluoropyridine | 3,5-DICHLORO-2,6-DIFLUORO-PYRIDINE | J-511279 | D75364 | FT-0614530 | pyridine, 3,5-dichloro-2,6-difluoro- | InChI=1/C5HCl2F2N/c6-2-1-3(7)5(9)10

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

C5HCl2F2N | MFCD03001157 | DS-5140 | A26077 | 1-Aminoindanehydrochloride | 3, 5-dichloro-2, 6-difluoropyridine | 3, 5-DICHLORO-2, 6-DIFLUORO-PYRIDINE | J-511279 | D75364 | FT-0614530 | pyridine, 3, 5-dichloro-2, 6-difluoro- | InChI=1/C5HCl2F2N/c6-2-1-3(7)5(9)10

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: 504759731
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759731
• Sonrisas canónicas: C1=C(C(=NC(=C1Cl)F)F)Cl
• IUPAC Name: 3,5-dichloro-2,6-difluoropyridine
• InChIKey: AYTUSKIZXVPKBR-UHFFFAOYSA-N
• INCHI: 1S/C5HCl2F2N/c6-2-1-3(7)5(9)10-4(2)8/h1H
• Isómeros SMILES: C1=C(C(=NC(=C1Cl)F)F)Cl
• Peso molecular: 183.97
• Reaxy-Rn: 1424723
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1424723&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: 2-halopyridines Aryl fluorides Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - 2-halopyridine - Aryl halide - Aryl fluoride - Aryl chloride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen 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

• Peso molecular: 183.970 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 182.945 Da
• Monoisotopic Mass: 182.945 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 112.000
• 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