2,3-Pyrazinedicarboxamide - ≥95% , CAS No.6164-78-9

CAS: 6164-78-9 Cat. No.: P467350 Formula: C₆H₆N₄O₂ Peso molecolare: 166.14 PubChem CID: 73173

GRADE & PURITY ≥95%

Synonyms

InChI=1/C6H6N4O2/c7-5(11)3-4(6(8)12)10-2-1-9-3/h1-2H,(H2,7,11)(H2,8,12) | SCHEMBL2492969 | Q27257051 | 2, diamide | 2,3-Pyrazinedicarboxamide, 95% | 2,3-Pyrazinedicarboxylic acid, diamide | TZMYZOQDDVSLJU-UHFFFAOYSA- | 2,3-PYRAZINEDICARBOXYLIC ACID DIAMID

Storage

Room temperature

Specifications

Sinonimi

InChI=1/C6H6N4O2/c7-5(11)3-4(6(8)12)10-2-1-9-3/h1-2H,(H2,7,11)(H2,8,12) | SCHEMBL2492969 | Q27257051 | 2, diamide | 2,3-Pyrazinedicarboxamide, 95% | 2,3-Pyrazinedicarboxylic acid, diamide | TZMYZOQDDVSLJU-UHFFFAOYSA- | 2,3-PYRAZINEDICARBOXYLIC ACID DIAMID

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Room temperature

Purezza

≥95%

Nomi e identificatori

Pubchem Sid

504754692

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754692

Sorrisi canonici

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

IUPAC Name

pyrazine-2,3-dicarboxamide

InChIKey

TZMYZOQDDVSLJU-UHFFFAOYSA-N

INCHI

1S/C6H6N4O2/c7-5(11)3-4(6(8)12)10-2-1-9-3/h1-2H,(H2,7,11)(H2,8,12)

Isomeri SMILES

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

WGK Germania

3

PubChem CID

73173

Peso molecolare

166.14

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazines
      • Subclass Pyrazines
        • Level5 Pyrazine carboxylic acids and derivatives
          • Level6 Pyrazinecarboxamides

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazines
• Subclass: Pyrazines
• Intermediate Tree Nodes: Pyrazine carboxylic acids and derivatives
• Direct Parent: Pyrazinecarboxamides
• Alternative Parents: 2-heteroaryl carboxamides Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrazinecarboxamide - 2-heteroaryl carboxamide - Heteroaromatic compound - Primary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as pyrazinecarboxamides. These are compounds containing a pyrazine ring which bears 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

Proprietà chimiche e fisiche

• Punto di fusione (°C): 248 °C
• Peso molecolare: 166.140 g/mol
• XLogP3: -2.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 166.049 Da
• Monoisotopic Mass: 166.049 Da
• Topological Polar Surface Area: 112.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 184.000
• 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

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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

The CAS Number is 6164-78-9, the molecular formula is C6H6N4O2, and the molecular weight is 166.14 g/mol. InChIKey TZMYZOQDDVSLJU-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.