6-Bromo-5,7-difluoroquinoline - ≥97% , CAS No.1022091-49-1

CAS: 1022091-49-1 Cat. No.: B165502 Peso molecular: 244.04 Número EC: 682-933-9

GRADE & PURITY ≥97%

Synonyms

AKOS015919335 | MFCD12828677 | AS-31506 | PB31669 | QUINOLINE, 6-BROMO-5,7-DIFLUORO- | SY006020 | FT-0657333 | 5,7-Difluoro-6-bromoquinoline | 1022091-49-1 | AC-24688 | DUAWZZRBLJDTQC-UHFFFAOYSA-N | 6-Bromo-5,7-difluoroquinoline, 97% | 6-Bromo-5,7-difluor

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

AKOS015919335 | MFCD12828677 | AS-31506 | PB31669 | QUINOLINE, 6-BROMO-5, 7-DIFLUORO- | SY006020 | FT-0657333 | 5, 7-Difluoro-6-bromoquinoline | 1022091-49-1 | AC-24688 | DUAWZZRBLJDTQC-UHFFFAOYSA-N | 6-Bromo-5, 7-difluoroquinoline, 97% | 6-Bromo-5, 7-difluor

Especificaciones y pureza

≥97%

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

≥97%

Nombres e identificadores

• Sonrisas canónicas: C1=CC2=C(C(=C(C=C2N=C1)F)Br)F
• IUPAC Name: 6-bromo-5,7-difluoroquinoline
• InChIKey: DUAWZZRBLJDTQC-UHFFFAOYSA-N
• INCHI: 1S/C9H4BrF2N/c10-8-6(11)4-7-5(9(8)12)2-1-3-13-7/h1-4H
• Isómeros SMILES: C1=CC2=C(C(=C(C=C2N=C1)F)Br)F
• WGK Alemania: 1
• Peso molecular: 244.04
• Reaxy-Rn: 18678860
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18678860&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Quinolines and derivatives
      • Subclass Haloquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Quinolines and derivatives
• Subclass: Haloquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Haloquinolines
• Alternative Parents: Pyridines and derivatives Benzenoids Aryl fluorides Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Haloquinoline - Benzenoid - Pyridine - Aryl halide - Aryl fluoride - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as haloquinolines. These are compounds containing a quinoline moiety, which is substituted at one or more ring positions by n 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: heat sensitive；light sensitive；moisture sensitive
• Punto de fusión (°C): 87-92 °C
• Peso molecular: 244.030 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 242.95 Da
• Monoisotopic Mass: 242.95 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 190.000
• 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