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1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde - 97%, high purity , CAS No.1010073-87-6
Discover 1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde by Aladdin Scientific in 97% for only $5,814.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
1H-Pyrazolo[3,4-b]pyridine-3-carbaldehyde | 1010073-87-6 | 1H-Pyrazolo[3,4-b]pyridine-3-carboxaldehyde | 2H-pyrazolo[3,4-b]pyridine-3-carbaldehyde | SCHEMBL1639312 | DTXSID50717151 | INXAQTGUMZSHQY-UHFFFAOYSA-N | 7-aza-1H-indazole-3-carboxaldehyde | MFCD11100578 | AKOS0063
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolopyridines
Alternative Parents
Aryl-aldehydes Pyridines and derivatives Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolopyridine - Aryl-aldehyde - Pyridine - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aldehyde - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolopyridines. These are compounds containing a pyrazolopyridine skeleton, which consists of a pyrazole fused to a pyridine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Pyridine is a 6-membered ring with four carbon and one nitrogen atoms.
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
2H-pyrazolo[3,4-b]pyridine-3-carbaldehyde
INCHI
InChI=1S/C7H5N3O/c11-4-6-5-2-1-3-8-7(5)10-9-6/h1-4H,(H,8,9,10)
InChIKey
INXAQTGUMZSHQY-UHFFFAOYSA-N
Smiles
C1=CC2=C(NN=C2N=C1)C=O
Isomeric SMILES
C1=CC2=C(NN=C2N=C1)C=O
PubChem CID
55265608
Molecular Weight
147.137
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
147.130 g/mol
XLogP3
0.600
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
147.043 Da
Monoisotopic Mass
147.043 Da
Topological Polar Surface Area
58.600 Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
162.000
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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