GRADE & PURITY ≥98%

Synonyms

AMY7717 | RYYKJLRAFMKRSC-UHFFFAOYSA-N | FT-0760743 | SY262161 | SCHEMBL3582732 | AS-17932 | BBL103557 | DTXSID10625506 | AU-004/43508426 | AMS_CNC_ID-1299621388 | SB71688 | EN300-106575 | E78010 | 6-BROMO-8-METHYLQUINOLINE | 6-Bromo-8-methyl-quinoline | Q

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinónimos

AMY7717 | RYYKJLRAFMKRSC-UHFFFAOYSA-N | FT-0760743 | SY262161 | SCHEMBL3582732 | AS-17932 | BBL103557 | DTXSID10625506 | AU-004/43508426 | AMS_CNC_ID-1299621388 | SB71688 | EN300-106575 | E78010 | 6-BROMO-8-METHYLQUINOLINE | 6-Bromo-8-methyl-quinoline | Q

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature, Desiccated

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CC1=CC(=CC2=C1N=CC=C2)Br
• IUPAC Name: 6-bromo-8-methylquinoline
• InChIKey: RYYKJLRAFMKRSC-UHFFFAOYSA-N
• INCHI: 1S/C10H8BrN/c1-7-5-9(11)6-8-3-2-4-12-10(7)8/h2-6H,1H3
• Isómeros SMILES: CC1=CC(=CC2=C1N=CC=C2)Br
• Peso molecular: 222.08
• Reaxy-Rn: 3627
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3627&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 bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Haloquinoline - Benzenoid - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - 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

• Peso molecular: 222.080 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 220.984 Da
• Monoisotopic Mass: 220.984 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 160.000
• 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