5-ethyl-6-oxo-1H-pyridazine-3-carboxylic acid - ≥97% , CAS No.1294451-76-5

CAS: 1294451-76-5 Cat. No.: E628146 Molecular Weight: 168.15 PubChem CID: 45108295

GRADE & PURITY ≥97%

Synonyms

1294451-76-5 | 5-Ethyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid | 5-ethyl-6-oxo-1H-pyridazine-3-carboxylic acid | MFCD26620710 | SY265465 | 5-Ethyl-6-oxo-1h-pyridazine-3-carboxylicacid | D79342

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1294451-76-5 | 5-Ethyl-6-oxo-1, 6-dihydropyridazine-3-carboxylic acid | 5-ethyl-6-oxo-1H-pyridazine-3-carboxylic acid | MFCD26620710 | SY265465 | 5-Ethyl-6-oxo-1h-pyridazine-3-carboxylicacid | D79342

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCC1=CC(=NNC1=O)C(=O)O
• IUPAC Name: 5-ethyl-6-oxo-1H-pyridazine-3-carboxylic acid
• InChIKey: HMEMCWOEWUSAPY-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O3/c1-2-4-3-5(7(11)12)8-9-6(4)10/h3H,2H2,1H3,(H,9,10)(H,11,12)
• PubChem CID: 45108295
• Molecular Weight: 168.15

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazines
      • Subclass Pyridazines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazines
• Subclass: Pyridazines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridazinones
• Alternative Parents: Heteroaromatic compounds Lactams Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridazinone - Heteroaromatic compound - Lactam - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as pyridazinones. These are compounds containing a pyridazine ring which bears a ketone.
• 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