2-Amino-5-Acetylpyridine - ≥97% , CAS No.19828-20-7

CAS: 19828-20-7 Cat. No.: E631325 Molecular Weight: 136.15 EC Number: 696-518-5 PubChem CID: 21113396

GRADE & PURITY ≥97%

Synonyms

AM85654 | DS-16689 | AB8078 | 1-(6-aminopyridin-3-yl)ethan-1-one | 1-(6-AMINO-PYRIDIN-3-YL)-ETHANONE | 1-(6-aminopyridin-3-yl)ethanone | 1-(6-Aminopyridin-3-yl)-ethanone | SCHEMBL1105486 | 1-(2-AMINOPYRIDIN-5-YL)ETHANONE | EN300-120456 | ETHANONE, 1-(6-AM

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

AM85654 | DS-16689 | AB8078 | 1-(6-aminopyridin-3-yl)ethan-1-one | 1-(6-AMINO-PYRIDIN-3-YL)-ETHANONE | 1-(6-aminopyridin-3-yl)ethanone | 1-(6-Aminopyridin-3-yl)-ethanone | SCHEMBL1105486 | 1-(2-AMINOPYRIDIN-5-YL)ETHANONE | EN300-120456 | ETHANONE, 1-(6-AM

Specifications & Purity

≥97%

Storage

Store at 2-8°C, Protected from light, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(=O)C1=CN=C(C=C1)N
• IUPAC Name: 1-(6-aminopyridin-3-yl)ethanone
• InChIKey: ZVXNDGKDTCTEBW-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O/c1-5(10)6-2-3-7(8)9-4-6/h2-4H,1H3,(H2,8,9)
• Isomeric SMILES: CC(=O)C1=CN=C(C=C1)N
• Alternate CAS: 19828-20-7
• PubChem CID: 21113396
• Molecular Weight: 136.15

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Aryl ketones
            • Level7 Aryl alkyl ketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones
• Direct Parent: Aryl alkyl ketones
• Alternative Parents: Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl alkyl ketone - Aminopyridine - Imidolactam - Pyridine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl 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

Associated Targets(non-human)

Pseudomonas aeruginosa (123386 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Light sensitive
• Molecular Weight: 136.150 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 136.064 Da
• Monoisotopic Mass: 136.064 Da
• Topological Polar Surface Area: 56.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 136.000
• 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

References

1. Ziwei Chen, Xueli Wang, Menghui Jia, Xiaoxiao He, Haifeng Pan, Jinquan Chen.  (2022)  Ribose and Deoxyribose Group Alter Excited-State Dynamics of 5-Azacytosine in Solution†.  PHOTOCHEMISTRY AND PHOTOBIOLOGY,      [PMID:35993879] [10.1111/php.13696]