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2-(4-Bromophenyl)imidazo[1,2-a]pyridine - 98%, high purity , CAS No.34658-66-7
Basic Description
Synonyms
2-(4-Bromophenyl)imidazo[1,2-a]pyridine | 34658-66-7 | CHEMBL1303604 | MFCD00218250 | 2-(4-Bromophenyl)imidazo(1,2-a)pyridine | 2-(4-Bromo-phenyl)-imidazo[1,2-a]pyridine | Imidazo[1,2-a]pyridine,2-(4-bromophenyl)- | Oprea1_612770 | Oprea1_768426 | MLS000711753 | SCHEMBL97253
Specifications & Purity
≥98%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
Imidazopyridines Imidazo[1,2-a]pyridines Bromobenzenes Pyridines and derivatives N-substituted imidazoles Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylimidazole - 5-phenylimidazole - Imidazo[1,2-a]pyridine - Imidazopyridine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - N-substituted imidazole - Heteroaromatic compound - Azacycle - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.
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.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
2-(4-bromophenyl)imidazo[1,2-a]pyridine
INCHI
InChI=1S/C13H9BrN2/c14-11-6-4-10(5-7-11)12-9-16-8-2-1-3-13(16)15-12/h1-9H
InChIKey
GRZUOGFRIHABDK-UHFFFAOYSA-N
Smiles
C1=CC2=NC(=CN2C=C1)C3=CC=C(C=C3)Br
Isomeric SMILES
C1=CC2=NC(=CN2C=C1)C3=CC=C(C=C3)Br
WGK Germany
3
Molecular Weight
273.13
Reaxy-Rn
163834
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=163834&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C)
216-220°C
Molecular Weight
273.130 g/mol
XLogP3
4.100
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
1
Exact Mass
271.995 Da
Monoisotopic Mass
271.995 Da
Topological Polar Surface Area
17.300 Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
238.000
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
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