pyrazine-2-carbaldehyde - ≥97% , CAS No.5780-66-5

CAS: 5780-66-5 Cat. No.: P176847 Formule: C₅H₄N₂O Poids moléculaire: 108.1 Numéro CE: 691-235-3 PubChem CID: 11274980

QUALITÉ & PURETÉ ≥97%

Synonyms

2-PYRAZINECARBALDEHYDE | Pyrazine-2-carboxaldehyde | BDBM92858 | DTXSID00460761 | EX42FX5JBS | PncA Inhibitor, 1 | pyrazine-2-carbaldehyde, AldrichCPR | 1,2-dihydro-2-oxo-4-pyridinecarboxaldehyde | 2-pyrazinecarboxaldehyde | Z1013412214 | A831615 | AM2007

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Spécifications

Synonymes

2-PYRAZINECARBALDEHYDE | Pyrazine-2-carboxaldehyde | BDBM92858 | DTXSID00460761 | EX42FX5JBS | PncA Inhibitor, 1 | pyrazine-2-carbaldehyde, AldrichCPR | 1,2-dihydro-2-oxo-4-pyridinecarboxaldehyde | 2-pyrazinecarboxaldehyde | Z1013412214 | A831615 | AM2007

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥97%

Noms et identifiants

Pubchem Sid

488197351

Sourires canoniques

C1=CN=C(C=N1)C=O

IUPAC Name

pyrazine-2-carbaldehyde

InChIKey

DXBWJLDFSICTIH-UHFFFAOYSA-N

INCHI

1S/C5H4N2O/c8-4-5-3-6-1-2-7-5/h1-4H

Isomères SMILES

C1=CN=C(C=N1)C=O

PubChem CID

11274980

Poids moléculaire

108.1

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Aldehydes
          • Level6 Aryl-aldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes
• Direct Parent: Aryl-aldehydes
• Alternative Parents: Pyrazines Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl-aldehyde - Pyrazine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aryl-aldehydes. These are compounds containing an aldehyde group directly attached to an aromatic ring.
• 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

Propriétés chimiques et physiques

• Poids moléculaire: 108.100 g/mol
• XLogP3: -0.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 108.032 Da
• Monoisotopic Mass: 108.032 Da
• Topological Polar Surface Area: 42.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 84.500
• 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

Foire aux questions

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 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 5780-66-5, the molecular formula is C5H4N2O, and the molecular weight is 108.1 g/mol. InChIKey DXBWJLDFSICTIH-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.