7-chloroimidazo[1,2-a]pyridine - ≥97% , CAS No.4532-25-6

CAS: 4532-25-6 Cat. No.: C176512 Peso molecular: 152.58 Número EC: 861-078-7

GRADE & PURITY ≥97%

Synonyms

DTXSID50599277 | 7-Chloroimdazo[1,2-a]pyridine | EN300-1197906 | J-519216 | PB34290 | 7-Chloro-imidazol[1,2-a]pyridine | 7-chloro-imidazo[1,2,a]pyridine | AC-5061 | SCHEMBL557352 | NGHRUBVFDAKWBC-UHFFFAOYSA-N | IMIDAZO[1,2-A]PYRIDINE, 7-CHLORO- | Z1198176

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

DTXSID50599277 | 7-Chloroimdazo[1, 2-a]pyridine | EN300-1197906 | J-519216 | PB34290 | 7-Chloro-imidazol[1, 2-a]pyridine | 7-chloro-imidazo[1, 2, a]pyridine | AC-5061 | SCHEMBL557352 | NGHRUBVFDAKWBC-UHFFFAOYSA-N | IMIDAZO[1, 2-A]PYRIDINE, 7-CHLORO- | Z1198176

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488199724
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488199724
• Sonrisas canónicas: C1=CN2C=CN=C2C=C1Cl
• IUPAC Name: 7-chloroimidazo[1,2-a]pyridine
• InChIKey: NGHRUBVFDAKWBC-UHFFFAOYSA-N
• INCHI: 1S/C7H5ClN2/c8-6-1-3-10-4-2-9-7(10)5-6/h1-5H
• Isómeros SMILES: C1=CN2C=CN=C2C=C1Cl
• Peso molecular: 152.58
• Reaxy-Rn: 508766
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=508766&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Imidazopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Imidazopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidazopyridines
• Alternative Parents: Imidazo[1,2-a]pyridines Pyridines and derivatives N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Imidazo[1,2-a]pyridine - Imidazopyridine - Aryl chloride - Aryl halide - N-substituted imidazole - Pyridine - Azole - Imidazole - Heteroaromatic compound - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as imidazopyridines. These are organic polycyclic compounds containing an imidazole ring fused to a pyridine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
• 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

• Punto de fusión (°C): 49-51℃
• Peso molecular: 152.580 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 152.014 Da
• Monoisotopic Mass: 152.014 Da
• Topological Polar Surface Area: 17.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 129.000
• 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