4-Methyl-2-p-tolylpyridine - ≥98%(HPLC) , CAS No.80635-92-3

CAS: 80635-92-3 Cat. No.: M290603 Formula: C₁₃H₁₃N Peso molecolare: 183.25 Numero EC: 835-087-1

GRADE & PURITY ≥98%(HPLC)

Synonyms

4-Methyl-2-p-tolyl-pyridine | AKOS006288136 | M3105 | SY235008 | AMY33063 | DTXSID30469909 | SCHEMBL6807225 | W17594 | 4-methyl-2-(4-methylphenyl)pyridine | MFCD09031945 | 4-Methyl-2-(p-tolyl)pyridine | AS-59187 | AC-20687

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

4-Methyl-2-p-tolyl-pyridine | AKOS006288136 | M3105 | SY235008 | AMY33063 | DTXSID30469909 | SCHEMBL6807225 | W17594 | 4-methyl-2-(4-methylphenyl)pyridine | MFCD09031945 | 4-Methyl-2-(p-tolyl)pyridine | AS-59187 | AC-20687

Specifiche e purezza

≥98%(HPLC)

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥98%(HPLC)

Nomi e identificatori

Pubchem Sid

488197637

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488197637

Sorrisi canonici

CC1=CC=C(C=C1)C2=NC=CC(=C2)C

IUPAC Name

4-methyl-2-(4-methylphenyl)pyridine

InChIKey

ZOIHWNNIRAGRNZ-UHFFFAOYSA-N

INCHI

1S/C13H13N/c1-10-3-5-12(6-4-10)13-9-11(2)7-8-14-13/h3-9H,1-2H3

Isomeri SMILES

CC1=CC=C(C=C1)C2=NC=CC(=C2)C

Peso molecolare

183.25

Reaxy-Rn

5924646

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5924646&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Phenylpyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Phenylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpyridines
• Alternative Parents: Toluenes Methylpyridines Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-phenylpyridine - Methylpyridine - Toluene - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
• 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

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive
• Peso molecolare: 183.250 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 183.105 Da
• Monoisotopic Mass: 183.105 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 170.000
• 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