2,6-Diclorofluorobenceno - ≥98%(GC) , CAS No.2268-05-5

CAS: 2268-05-5 Cat. No.: D155249 Fórmula: C_l2C₆H₃F Peso molecular: 164.99 Beilstein Registry Number: 5(4)662 Número EC: 607-128-1

GRADE & PURITY ≥98%(GC)

Synonyms

FS-4027 | 1,3-Dichloro-2-fluorobenzene | 1,3-Dichloro-2-fluoro-benzene | 2,6-Dichloro-1-fluorobenzene | DTXSID50177211 | 2,6-Dichlorofluorobenzene | AC-3198 | D2485 | FT-0610613 | AM20060914 | InChI=1/C6H3Cl2F/c7-4-2-1-3-5(8)6(4)9/h1-3 | Benzene,1,3-dichl

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

FS-4027 | 1,3-Dichloro-2-fluorobenzene | 1,3-Dichloro-2-fluoro-benzene | 2,6-Dichloro-1-fluorobenzene | DTXSID50177211 | 2,6-Dichlorofluorobenzene | AC-3198 | D2485 | FT-0610613 | AM20060914 | InChI=1/C6H3Cl2F/c7-4-2-1-3-5(8)6(4)9/h1-3 | Benzene,1,3-dichl

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 508807800
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508807800
• Sonrisas canónicas: C1=CC(=C(C(=C1)Cl)F)Cl
• IUPAC Name: 1,3-dichloro-2-fluorobenzene
• InChIKey: JORVCRLRRRRLFI-UHFFFAOYSA-N
• INCHI: 1S/C6H3Cl2F/c7-4-2-1-3-5(8)6(4)9/h1-3H
• Isómeros SMILES: C1=CC(=C(C(=C1)Cl)F)Cl
• Peso molecular: 164.99
• Beilstein: 5(4)662
• Reaxy-Rn: 1862513
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1862513&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Level5 Chlorobenzenes
          • Level6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: Fluorobenzenes Aryl fluorides Aryl chlorides Organofluorides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1,3-dichlorobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Aryl chloride - Hydrocarbon derivative - Organofluoride - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• 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 inflamación (°F): 163°F
• Punto de inflamación (°C): 73°C
• Punto de ebullición (°C): 168-169°C
• Punto de fusión (°C): 37-40°C
• Peso molecular: 164.990 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 163.96 Da
• Monoisotopic Mass: 163.96 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 87.100
• 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