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6-(3-Aminophenyl)picolinic acid - 97%, high purity , CAS No.1261925-21-6
Basic Description
Synonyms
6-(3-Aminophenyl)picolinic acid | 1261925-21-6 | 6-(3-aminophenyl)pyridine-2-carboxylic acid | 6-(3-Aminophenyl)picolinicacid | DTXSID60611257 | MFCD18316760 | AKOS015893238 | BS-20196 | CS-0208663 | 2-Pyridinecarboxylic acid, 6-(3-aminophenyl)- | A889568
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Phenylpyridines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyridines
Alternative Parents
Pyridinecarboxylic acids Aniline and substituted anilines Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Primary amines Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyridine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Amino acid - Amino acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine 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.
Names and Identifiers
IUPAC Name
6-(3-aminophenyl)pyridine-2-carboxylic acid
INCHI
InChI=1S/C12H10N2O2/c13-9-4-1-3-8(7-9)10-5-2-6-11(14-10)12(15)16/h1-7H,13H2,(H,15,16)
InChIKey
APPZUWSRWDJQDL-UHFFFAOYSA-N
Smiles
C1=CC(=CC(=C1)N)C2=NC(=CC=C2)C(=O)O
Isomeric SMILES
C1=CC(=CC(=C1)N)C2=NC(=CC=C2)C(=O)O
PubChem CID
21191149
Molecular Weight
214.2
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
214.220 g/mol
XLogP3
1.700
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
214.074 Da
Monoisotopic Mass
214.074 Da
Topological Polar Surface Area
76.200 Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
257.000
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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