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2,2'-Bipyridine-4-carboxylic acid - 98%, high purity , CAS No.1748-89-6
Basic Description
Synonyms
2,2-bipyridyl-4-carboxylic | TS-02831 | BDBM50498673 | DTXSID50433122 | 2-pyridin-2-ylpyridine-4-carboxylic Acid | 2,2'-bipyridine-4-carboxylic acid, AldrichCPR | YSCH0069 | 2,2'-BIPYRIDINE-4-CARBOXYLIC ACID | BAA74889 | 2,2/'-Bipyridine-4-carboxylic acid
Specifications & Purity
≥98%
Storage Temp
Room temperature,Desiccated
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Bipyridines and oligopyridines
Intermediate Tree Nodes
Not available
Direct Parent
Bipyridines and oligopyridines
Alternative Parents
Pyridinecarboxylic acids Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Bipyridine - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Heteroaromatic compound - 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 bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other.
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)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
Pubchem Sid
504765130
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504765130
IUPAC Name
2-pyridin-2-ylpyridine-4-carboxylic acid
INCHI
InChI=1S/C11H8N2O2/c14-11(15)8-4-6-13-10(7-8)9-3-1-2-5-12-9/h1-7H,(H,14,15)
InChIKey
FRYSEKUUHUUJPX-UHFFFAOYSA-N
Smiles
C1=CC=NC(=C1)C2=NC=CC(=C2)C(=O)O
Isomeric SMILES
C1=CC=NC(=C1)C2=NC=CC(=C2)C(=O)O
Molecular Weight
200.2
Reaxy-Rn
8312859
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8312859&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°C)
257.689°C
Boil Point(°C)
502.477°C
Molecular Weight
200.190 g/mol
XLogP3
1.000
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
200.059 Da
Monoisotopic Mass
200.059 Da
Topological Polar Surface Area
63.100 Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
233.000
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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