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

CAS: 2268-05-5 Cat. No.: D155249 Summenformel: C_l2C₆H₃F Molekulargewicht: 164.99 Beilstein Registry Number: 5(4)662 EG-Nummer: 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

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

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

Spezifikationen & Reinheit

≥98%(GC)

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%(GC)

Namen und Kennungen

Pubchem Sid

508807800

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508807800

Kanonisches Lächeln

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

Isomere SMILES

C1=CC(=C(C(=C1)Cl)F)Cl

Molekulargewicht

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
    • Klasse Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Ebene5 Chlorobenzenes
          • Ebene6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: 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
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Flammpunkt (°F): 163°F
• Flammpunkt (°C): 73°C
• Siedepunkt (°C): 168-169°C
• Schmelzpunkt (°C): 37-40°C
• Molekulargewicht: 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