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8-methoxyimidazo[1,2-a]pyridine-2-carboxylic acid - 97%, high purity , CAS No.910122-85-9
Basic Description
Synonyms
8-METHOXYIMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID | 910122-85-9 | SCHEMBL1201345 | DTXSID10736085 | KYIVMSMDDXMNOA-UHFFFAOYSA-N | AKOS017516121 | SB21133 | AS-38920 | CS-0049945 | EN300-2716340 | A860631 | 8-methoxy-imidazo[1,2-a]pyridine-2-carboxylic acid | imidazo[1,2-a]pyridi
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Imidazopyridines
Alternative Parents
Imidazo[1,2-a]pyridines Carbonylimidazoles Alkyl aryl ethers Pyridines and derivatives N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Imidazo[1,2-a]pyridine - Imidazopyridine - Alkyl aryl ether - Imidazole-4-carbonyl group - Pyridine - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
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.
Names and Identifiers
IUPAC Name
8-methoxyimidazo[1,2-a]pyridine-2-carboxylic acid
INCHI
InChI=1S/C9H8N2O3/c1-14-7-3-2-4-11-5-6(9(12)13)10-8(7)11/h2-5H,1H3,(H,12,13)
InChIKey
KYIVMSMDDXMNOA-UHFFFAOYSA-N
Smiles
COC1=CC=CN2C1=NC(=C2)C(=O)O
Isomeric SMILES
COC1=CC=CN2C1=NC(=C2)C(=O)O
Molecular Weight
192.1714
Reaxy-Rn
44588492
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=44588492&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
192.170 g/mol
XLogP3
1.600
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
192.053 Da
Monoisotopic Mass
192.053 Da
Topological Polar Surface Area
63.800 Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
234.000
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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