2-Hydroxy-6-(4-methylphenyl)pyridine - ≥98% , CAS No.129720-57-6

CAS: 129720-57-6 Cat. No.: H181052 Summenformel: C₁₂H₁₁NO Molekulargewicht: 185.2

GRADE & PURITY ≥98%

Synonyms

6-(p-Tolyl)pyridin-2-ol|129720-57-6|2-HYDROXY-6-(4-METHYLPHENYL)PYRIDINE|6-(4-methylphenyl)-1H-pyridin-2-one|6-(4-tolyl)-2(1h)-pyridone|DTXSID50396586|MFCD11876311|AKOS015892411|AKOS024272257|SB53090|6-(4-Methylphenyl)pyridin-2(1H)-one|6-(4-METHYLPHENYL)P

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

6-(p-Tolyl)pyridin-2-ol | 129720-57-6 | 2-HYDROXY-6-(4-METHYLPHENYL)PYRIDINE | 6-(4-methylphenyl)-1H-pyridin-2-one | 6-(4-tolyl)-2(1h)-pyridone | DTXSID50396586 | MFCD11876311 | AKOS015892411 | AKOS024272257 | SB53090 | 6-(4-Methylphenyl)pyridin-2(1H)-one | 6-(4-METHYLPHENYL)P

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln

CC1=CC=C(C=C1)C2=CC=CC(=O)N2

IUPAC Name

6-(4-methylphenyl)-1H-pyridin-2-one

InChIKey

VKNQQUHTPUVQJD-UHFFFAOYSA-N

INCHI

1S/C12H11NO/c1-9-5-7-10(8-6-9)11-3-2-4-12(14)13-11/h2-8H,1H3,(H,13,14)

Isomere SMILES

CC1=CC=C(C=C1)C2=CC=CC(=O)N2

Molekulargewicht

185.2

Reaxy-Rn

1450005

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1450005&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Phenylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpyridines
• Alternative Parents: Toluenes Pyridinones Dihydropyridines Heteroaromatic compounds Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-phenylpyridine - Dihydropyridine - Pyridinone - Toluene - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Heteroaromatic compound - Lactam - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 185.220 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 185.084 Da
• Monoisotopic Mass: 185.084 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 283.000
• 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.

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 129720-57-6, the molecular formula is C12H11NO, and the molecular weight is 185.2 g/mol. InChIKey VKNQQUHTPUVQJD-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.