6-Azauracil - ≥99% , CAS No.461-89-2

CAS: 461-89-2 Cat. No.: A124269 Fórmula: C₃H₃N₃O₂ Peso molecular: 113.07 Beilstein Registry Number: 116472 Número CE: 207-318-0

GRAU & PUREZA ≥99%

Synonyms

2H-1,2,4-triazine-3,5-dione|3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine|4(6)-Azauracil|3-hydroxy-1,2,4-triazin-5(4H)-one|3,5-Dioxo-[1,2,4]triazine|USAF CB-30|2H-[1,2,4]triazine-3,5-dione|1,4-Triazine-3,5(2H,4H)-dione|2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione|3,5-Dihydroxy-1,2,4-triazine|2h-[1,2,4]triazin-3,5-dione|s-Triazine-3,5(2H,4H)-dione|as-Triazine-3,5(2H,4H)-dione|IPO 3834|1,2,4-Triazine-3,5-dione|6-Azauracil|6-aza-uracil|1,2,4-Triazine-3,5(2H,4H)-dione|3,5-dioxo-(2H,4H)-1,2,4-triazine|[1,2,4]triazine-3,5-diol|6-Aza-2,4-dihydroxypyrimidine|Azauracil|1,2,4-Triazine-3,5(2H,4H)-dione,dihydro-|1,2,4-Triazine-3,5-diol|as-Triazine-3,4H)-dione

Storage

Room temperature

Shipped In

Normal

Visão geral

6-Azauracil is used as a growth inhibitor of various microorganisms via depletion of intracellular GTP and UTP nucleotide pools. 6-Azauracil has been widely used in investigations on modulation of transcription, especially in yeast models.
A growth inhibitor of various microorganisms

Especificações

Sinónimos

2H-1,2,4-triazine-3,5-dione | 3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazine | 4(6)-Azauracil | 3-hydroxy-1,2,4-triazin-5(4H)-one | 3,5-Dioxo-[1,2,4]triazine | USAF CB-30 | 2H-[1,2,4]triazine-3,5-dione | 1,4-Triazine-3,5(2H,4H)-dione | 2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione | 3,5-Dihydroxy-1,2,4-triazine | 2h-[1,2,4]triazin-3,5-dione | Show more

Especificações e pureza

≥99%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥99%

Nomes e identificadores

Pubchem Sid

488184074

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488184074

Sorrisos canónicos

C1=NNC(=O)NC1=O

IUPAC Name

2H-1,2,4-triazine-3,5-dione

InChIKey

SSPYSWLZOPCOLO-UHFFFAOYSA-N

INCHI

1S/C3H3N3O2/c7-2-1-4-6-3(8)5-2/h1H,(H2,5,6,7,8)

SMILES isoméricas

C1=NNC(=O)NC1=O

WGK Alemanha

3

RTECS

XY7700000

Peso molecular

113.07

Beilstein

116472

Reaxy-Rn

116472

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=116472&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Triazines
      • Subclass 1,2,4-triazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Triazines
• Subclass: 1,2,4-triazines
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,2,4-triazines
• Alternative Parents: Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 1,2,4-triazine - Heteroaromatic compound - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 1,2,4-triazines. These are compounds containing a triazine ring, which is a heterocyclic ring, similar to the six-member benzene ring but with three carbons replaced by nitrogen atoms, at ring positions 1, 2, and 4.
• External Descriptors: 1,2,4-triazines

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

Alvos associados (não humanos)

Proteus vulgaris (5823 Activities)

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Staphylococcus aureus (210822 Activities)

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Staphylococcus epidermidis (22802 Activities)

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Bordetella bronchiseptica (483 Activities)

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Bacillus subtilis (32866 Activities)

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Bacillus cereus (7522 Activities)

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Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in water (partly), ethanol, DMSO, and 1 M NH4OH (50 mg/ml).
• Ponto de fusão (°C): 274-282°C
• Peso molecular: 113.080 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 113.023 Da
• Monoisotopic Mass: 113.023 Da
• Topological Polar Surface Area: 70.600 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 162.000
• 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 ≥99% 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 461-89-2, the molecular formula is C3H3N3O2, and the molecular weight is 113.07 g/mol. InChIKey SSPYSWLZOPCOLO-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.