2-Bromo-6-methylpyridine - ≥98% , CAS No.5315-25-3

CAS: 5315-25-3 Cat. No.: B101571 Summenformel: C₆H₆BrN Molekulargewicht: 172.02 Beilstein Registry Number: 20(3/4)2705 EG-Nummer: 226-173-4

GRADE & PURITY ≥98%

Synonyms

(2S,3R,4S,5S,6R)-2-(6-bromonaphthalen-2-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol | MFCD00040743 | SY001968 | AKOS005255682 | SCHEMBL103431 | 2-Bromo-6-picoline | B2114 | DTXSID70201229 | 6-bromopicoline | m-methoxybenzenethiol | 2-bromo-6-methylpyridine;

Storage

Room temperature,Argon charged

Shipped In

Normal

Übersicht

2-Bromo-6-methylpyridine is a bromopyridine derivative. It is formed when 2-chloro-6-methylpyridine is heated with bromotrimethylsilane.[1] Its synthesis from various methods have been reported

Specifications

Synonyme

(2S,3R,4S,5S,6R)-2-(6-bromonaphthalen-2-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol | MFCD00040743 | SY001968 | AKOS005255682 | SCHEMBL103431 | 2-Bromo-6-picoline | B2114 | DTXSID70201229 | 6-bromopicoline | m-methoxybenzenethiol | 2-bromo-6-methylpyridine;

Spezifikationen & Reinheit

≥98%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488185690

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488185690

Kanonisches Lächeln

CC1=NC(=CC=C1)Br

IUPAC Name

2-bromo-6-methylpyridine

InChIKey

SOHDPICLICFSOP-UHFFFAOYSA-N

INCHI

1S/C6H6BrN/c1-5-3-2-4-6(7)8-5/h2-4H,1H3

Isomere SMILES

CC1=NC(=CC=C1)Br

WGK Deutschland

3

Molekulargewicht

172.02

Beilstein

20(3/4)2705

Reaxy-Rn

107322

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107322&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-halopyridines
• Alternative Parents: Methylpyridines Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-halopyridine - 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 2-halopyridines. These are organic compounds containing a pyridine ring substituted at the 2-position by a 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 chloroform, ethyl aceate. Not miscible or difficult to mix with water.
• Empfindlichkeit: air sensitive
• Brechungsindex: 1.562
• Flammpunkt (°F): 206.6 °F
• Flammpunkt (°C): 97 °C
• Siedepunkt (°C): 102-103°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