2-Bromoquinoline - ≥98% , CAS No.2005-43-8

CAS: 2005-43-8 Cat. No.: B123564 Summenformel: C₉H₆BrN Molekulargewicht: 208.05 Beilstein Registry Number: 20(5)7,318 EG-Nummer: 679-582-9

GRADE & PURITY ≥98%

Synonyms

2-Bromoquinoline, 97% | SCHEMBL9430 | AC-907/25004859 | A4387 | PS-8052 | STL556080 | Quinoline, 2-bromo- | bromoquinoline | W-206482 | B3524 | AM20061832 | AC-6956 | 2-Bromoquinoline, 95% | J-650205 | DTXSID90376423 | EN300-83375 | 2-bromoquinoline | MFC

Storage

Protected from light,Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyme

2-Bromoquinoline, 97% | SCHEMBL9430 | AC-907/25004859 | A4387 | PS-8052 | STL556080 | Quinoline, 2-bromo- | bromoquinoline | W-206482 | B3524 | AM20061832 | AC-6956 | 2-Bromoquinoline, 95% | J-650205 | DTXSID90376423 | EN300-83375 | 2-bromoquinoline | MFC

Spezifikationen & Reinheit

≥98%

Storage

Protected from light,Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 504761686
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761686
• Kanonisches Lächeln: C1=CC=C2C(=C1)C=CC(=N2)Br
• IUPAC Name: 2-bromoquinoline
• InChIKey: QKJAZPHKNWSXDF-UHFFFAOYSA-N
• INCHI: 1S/C9H6BrN/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
• Isomere SMILES: C1=CC=C2C(=C1)C=CC(=N2)Br
• WGK Deutschland: 3
• Molekulargewicht: 208.05
• Beilstein: 20(5)7,318
• Reaxy-Rn: 112562
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=112562&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Quinolines and derivatives
• Subclass: Haloquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Haloquinolines
• Alternative Parents: 2-halopyridines Benzenoids Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Haloquinoline - 2-halopyridine - Benzenoid - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in Methanol
• Empfindlichkeit: Light sensitive
• Flammpunkt (°F): >230 °F
• Flammpunkt (°C): >110 °C
• Siedepunkt (°C): 115°C/0.3mmHg
• Schmelzpunkt (°C): 49 °C
• Molekulargewicht: 208.050 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 206.968 Da
• Monoisotopic Mass: 206.968 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 138.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2005-43-8, the molecular formula is C9H6BrN, and the molecular weight is 208.05 g/mol. InChIKey QKJAZPHKNWSXDF-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.