4-bromopyridine-2-carboxamide - ≥97% , CAS No.62150-46-3

CAS: 62150-46-3 Cat. No.: B176958 Fórmula: C₆H₅BrN₂O Peso molecular: 201.023 Número CE: 162-259-7

GRAU & PUREZA ≥97%

Synonyms

AC-9580 | SCHEMBL786245 | AMY4782 | FT-0645208 | TS-02850 | STL230888 | 4-bromo-2-pyridinecarboxamide | 4-Bromo-pyridine-2-carboxylic acid amide | AKOS000320191 | A26063 | DTXSID20351208 | 4-bromopyridine-2-carboxamide | HOKMIQUAXGAICH-UHFFFAOYSA-N | 4-Br

Storage

Room temperature

Shipped In

Normal

Especificações

Sinónimos

AC-9580 | SCHEMBL786245 | AMY4782 | FT-0645208 | TS-02850 | STL230888 | 4-bromo-2-pyridinecarboxamide | 4-Bromo-pyridine-2-carboxylic acid amide | AKOS000320191 | A26063 | DTXSID20351208 | 4-bromopyridine-2-carboxamide | HOKMIQUAXGAICH-UHFFFAOYSA-N | 4-Br

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

488191165

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488191165

Sorrisos canónicos

C1=CN=C(C=C1Br)C(=O)N

IUPAC Name

4-bromopyridine-2-carboxamide

InChIKey

HOKMIQUAXGAICH-UHFFFAOYSA-N

INCHI

1S/C6H5BrN2O/c7-4-1-2-9-5(3-4)6(8)10/h1-3H,(H2,8,10)

SMILES isoméricas

C1=CN=C(C=C1Br)C(=O)N

Peso molecular

201.023

Reaxy-Rn

386582

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=386582&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinecarboxamides
• Alternative Parents: 2-heteroaryl carboxamides Aryl bromides Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridinecarboxamide - 2-heteroaryl carboxamide - Aryl bromide - Aryl halide - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as pyridinecarboxamides. These are compounds containing a pyridine ring bearing a carboxamide.
• 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

Propriedades químicas e físicas

• Peso molecular: 201.020 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 199.959 Da
• Monoisotopic Mass: 199.959 Da
• Topological Polar Surface Area: 56.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 140.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥97% 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 62150-46-3, the molecular formula is C6H5BrN2O, and the molecular weight is 201.023 g/mol. InChIKey HOKMIQUAXGAICH-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.