GRADE & PURITY ≥98%(GC)

Synonyms

imidazo[1,2-alpha]pyrimidine | 9X-0834 | 1,8-Diazaindolizine | Imidazo[1,2-a]pyrimidine | DTXSID80341928 | AM20090342 | J-521506 | 1,3a,7-Triazaindene | 8-Azapyrimidazole | I0798 | BB 0261951 | SCHEMBL66214 | STL302092 | Imidazo[1 pound not2-a]pyrimidine

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

imidazo[1, 2-alpha]pyrimidine | 9X-0834 | 1, 8-Diazaindolizine | Imidazo[1, 2-a]pyrimidine | DTXSID80341928 | AM20090342 | J-521506 | 1, 3a, 7-Triazaindene | 8-Azapyrimidazole | I0798 | BB 0261951 | SCHEMBL66214 | STL302092 | Imidazo[1 pound not2-a]pyrimidine

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 488190399
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488190399
• Sonrisas canónicas: C1=CN2C=CN=C2N=C1
• IUPAC Name: imidazo[1,2-a]pyrimidine
• InChIKey: INSWZAQOISIYDT-UHFFFAOYSA-N
• INCHI: 1S/C6H5N3/c1-2-7-6-8-3-5-9(6)4-1/h1-5H
• Isómeros SMILES: C1=CN2C=CN=C2N=C1
• Peso molecular: 119.13
• Reaxy-Rn: 606559
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606559&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Imidazo[1,2-a]pyrimidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Imidazo[1,2-a]pyrimidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidazo[1,2-a]pyrimidines
• Alternative Parents: Pyrimidines and pyrimidine derivatives N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Imidazo[1,2-a]pyrimidine - Pyrimidine - N-substituted imidazole - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as imidazo[1,2-a]pyrimidines. These are aromatic heteropolycyclic compounds containing an imidazole ring fused to and sharing one nitrogen with a pyrimidine ring.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in Methanol
• Punto de fusión (°C): 127 °C
• Peso molecular: 119.120 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 119.048 Da
• Monoisotopic Mass: 119.048 Da
• Topological Polar Surface Area: 30.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 104.000
• 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