2-Acetamidopyridine - ≥98%(GC) , CAS No.5231-96-9

CAS: 5231-96-9 Cat. No.: A151788 Formula: C₇H₈N₂O Peso molecolare: 136.15 Beilstein Registry Number: 22(5)8,323 Numero EC: 684-379-3

GRADE & PURITY ≥98%(GC)

Synonyms

N-(2-pyridyl)acetamide | AKOS003277542 | Acetamide, N-2-pyridinyl- | N-(pyridin-2-yl)acetamide | 2-Acetylaminopyridine | AH-283/32233018 | 2-acetaminopyridine | ACETAMIDE,N-2(1H)-PYRIDINYLIDENE- | Acetamidopyridine | N-(2-Pyridinyl)acetamide # | NSC28291

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

N-(2-pyridyl)acetamide | AKOS003277542 | Acetamide, N-2-pyridinyl- | N-(pyridin-2-yl)acetamide | 2-Acetylaminopyridine | AH-283/32233018 | 2-acetaminopyridine | ACETAMIDE,N-2(1H)-PYRIDINYLIDENE- | Acetamidopyridine | N-(2-Pyridinyl)acetamide # | NSC28291

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 488184743
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184743
• Sorrisi canonici: CC(=O)NC1=CC=CC=N1
• IUPAC Name: N-pyridin-2-ylacetamide
• InChIKey: QROKOTBWFZITJZ-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O/c1-6(10)9-7-4-2-3-5-8-7/h2-5H,1H3,(H,8,9,10)
• Isomeri SMILES: CC(=O)NC1=CC=CC=N1
• RTECS: AC7859000
• Peso molecolare: 136.15
• Beilstein: 22(5)8,323
• Reaxy-Rn: 113841
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=113841&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass N-arylamides

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: N-arylamides
• Intermediate Tree Nodes: Not available
• Direct Parent: N-acetylarylamines
• Alternative Parents: Pyridines and derivatives Imidolactams Heteroaromatic compounds Acetamides Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-acetylarylamine - Pyridine - Imidolactam - Heteroaromatic compound - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as n-acetylarylamines. These are acetamides where one or more amide hydrogens is substituted by an aryl 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in Methanol
• Punto di ebollizione (°C): 148 °C/13 mmHg
• Punto di fusione (°C): 69 °C
• Peso molecolare: 136.150 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 136.064 Da
• Monoisotopic Mass: 136.064 Da
• Topological Polar Surface Area: 42.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 125.000
• 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

Domande frequenti

How should this product be stored?

Store at room temperature.

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

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 5231-96-9, the molecular formula is C7H8N2O, and the molecular weight is 136.15 g/mol. InChIKey QROKOTBWFZITJZ-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.