4-Bromo-2-methylpyridine - ≥97% , CAS No.22282-99-1

CAS: 22282-99-1 Cat. No.: B591103 Summenformel: C₆H₆BrN Molekulargewicht: 172.02 Beilstein Registry Number: 20(5)5,501 EG-Nummer: 624-896-3

GRADE & PURITY ≥97%

Synonyms

4-bromo-6-methylpyridine | DTXSID20376496 | 4-Bromo-2-methylpyridine | 4-bromo-2-methyl-pyridine | 4bromo-2-methylpyridine | BCP22098 | AN-584/43413320 | 4-bromo-2-methylpyridin | 4-bromo-2-methyl pyridine | MFCD03788196 | FT-0650271 | HY-W007447 | 4-Brom

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

4-bromo-6-methylpyridine | DTXSID20376496 | 4-Bromo-2-methylpyridine | 4-bromo-2-methyl-pyridine | 4bromo-2-methylpyridine | BCP22098 | AN-584/43413320 | 4-bromo-2-methylpyridin | 4-bromo-2-methyl pyridine | MFCD03788196 | FT-0650271 | HY-W007447 | 4-Brom

Spezifikationen & Reinheit

≥97%

Storage

Protected from light,Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Pubchem Sid: 528760598
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/528760598
• Kanonisches Lächeln: CC1=NC=CC(=C1)Br
• IUPAC Name: 4-bromo-2-methylpyridine
• InChIKey: JFBMFWHEXBLFCR-UHFFFAOYSA-N
• INCHI: 1S/C6H6BrN/c1-5-4-6(7)2-3-8-5/h2-4H,1H3
• Isomere SMILES: CC1=NC=CC(=C1)Br
• WGK Deutschland: 3
• Molekulargewicht: 172.02
• Beilstein: 20(5)5,501
• Reaxy-Rn: 107332
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107332&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Methylpyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Methylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Methylpyridines
• Alternative Parents: Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Methylpyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as methylpyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a methyl group.
• 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Miscible with dichloromethane. Immiscible with water.
• Empfindlichkeit: Sensitive to air; Sensitivity to humidity; Sensitive to light
• Brechungsindex: 1.556
• Flammpunkt (°F): 172.4 °F
• Flammpunkt (°C): 79°C
• Siedepunkt (°C): 76°C
• Molekulargewicht: 172.020 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 170.968 Da
• Monoisotopic Mass: 170.968 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.900
• 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