acido 2-idrossi-5-nitronicotinico - ≥98% , CAS No.6854-07-5

CAS: 6854-07-5 Cat. No.: H119255 Formula: C₆H₄N₂O₅ Peso molecolare: 184.11 Numero EC: 642-763-8

GRADE & PURITY ≥98%

Synonyms

5-nitro-2-oxo-1,2-dihydropyridine-3-carboxylic acid | A24688 | MFCD05669267 | AKOS000265593 | FT-0654920 | 5-nitro-2-oxo-1H-pyridine-3-carboxylic Acid | AB22442 | EN300-14847 | AC-22851 | BBL100588 | 2-hydroxy-5-nitro-3-pyridinecarboxylic acid | 2-Hydroxy

Storage

Room temperature

Shipped In

Normale

Specifications

Sinonimi

5-nitro-2-oxo-1,2-dihydropyridine-3-carboxylic acid | A24688 | MFCD05669267 | AKOS000265593 | FT-0654920 | 5-nitro-2-oxo-1H-pyridine-3-carboxylic Acid | AB22442 | EN300-14847 | AC-22851 | BBL100588 | 2-hydroxy-5-nitro-3-pyridinecarboxylic acid | 2-Hydroxy

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normale

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 504763231
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504763231
• Sorrisi canonici: C1=C(C(=O)NC=C1[N+](=O)[O-])C(=O)O
• IUPAC Name: 5-nitro-2-oxo-1H-pyridine-3-carboxylic acid
• InChIKey: JVLVOEQOJYFQKR-UHFFFAOYSA-N
• INCHI: 1S/C6H4N2O5/c9-5-4(6(10)11)1-3(2-7-5)8(12)13/h1-2H,(H,7,9)(H,10,11)
• Isomeri SMILES: C1=C(C(=O)NC=C1[N+](=O)[O-])C(=O)O
• Peso molecolare: 184.11
• Reaxy-Rn: 6598178
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6598178&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: Pyridinecarboxylic acids
• Alternative Parents: Dihydropyridinecarboxylic acids and derivatives Nitroaromatic compounds Pyridinones Vinylogous amides Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Organic oxoazanium compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts Organonitrogen compounds Organic cations
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Nitroaromatic compound - Dihydropyridine - Pyridinone - Hydropyridine - Heteroaromatic compound - Vinylogous amide - Lactam - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organic cation - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid 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

Proprietà chimiche e fisiche

• Punto di fusione (°C): 244-248°C
• Peso molecolare: 184.110 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 184.012 Da
• Monoisotopic Mass: 184.012 Da
• Topological Polar Surface Area: 112.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 349.000
• 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 ≥98% 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 6854-07-5, the molecular formula is C6H4N2O5, and the molecular weight is 184.11 g/mol. InChIKey JVLVOEQOJYFQKR-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.