4-Methyl-2,2'-bipyridine - ≥98% , CAS No.56100-19-7

CAS: 56100-19-7 Cat. No.: M589487 Summenformel: C₁₁H₁₀N₂ Molekulargewicht: 170.21 EG-Nummer: 111-192-1

GRADE & PURITY ≥98%

Synonyms

A870021 | 4-Methyl-[2,2']bipyridinyl | MFCD08062570 | AMY18771 | DTXSID60452061 | 4'-methyl-2,2'-bipyridine | 4-METHYL-2,2'-BIPYRIDINE | BS-52235 | J-400624 | SCHEMBL563123 | N12815 | 4-methyl-2-pyridin-2-ylpyridine | OHSRAWAUPZWNKY-UHFFFAOYSA-N | AKOS006

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Specifications

Synonyme

A870021 | 4-Methyl-[2,2']bipyridinyl | MFCD08062570 | AMY18771 | DTXSID60452061 | 4'-methyl-2,2'-bipyridine | 4-METHYL-2,2'-BIPYRIDINE | BS-52235 | J-400624 | SCHEMBL563123 | N12815 | 4-methyl-2-pyridin-2-ylpyridine | OHSRAWAUPZWNKY-UHFFFAOYSA-N | AKOS006

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C,Desiccated

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

• Kanonisches Lächeln: CC1=CC(=NC=C1)C2=CC=CC=N2
• IUPAC Name: 4-methyl-2-pyridin-2-ylpyridine
• InChIKey: OHSRAWAUPZWNKY-UHFFFAOYSA-N
• INCHI: 1S/C11H10N2/c1-9-5-7-13-11(8-9)10-4-2-3-6-12-10/h2-8H,1H3
• Isomere SMILES: CC1=CC(=NC=C1)C2=CC=CC=N2
• Molekulargewicht: 170.21
• Reaxy-Rn: 637873
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=637873&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Bipyridines and oligopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Bipyridines and oligopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Bipyridines and oligopyridines
• Alternative Parents: Methylpyridines Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Bipyridine - Methylpyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other.
• 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

• Molekulargewicht: 170.210 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 170.084 Da
• Monoisotopic Mass: 170.084 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 158.000
• 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