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2-Oxo-5-phenyl-1，2-dihydropyridine-3-carboxylic acid - ≥95%, high purity , CAS No.10177-08-9

COA

Grade & Purity:

≥95%

Cas Number: 10177-08-9
Molecular Weight: 215.2
PubChem CID: 10375975

In stock

Item Number

O710703

Grouped product items
SKU	Size	Availability	Price	Qty
O710703-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,107.90
O710703-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,214.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Phenylpyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Phenylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpyridines
Alternative Parents	Pyridinecarboxylic acids Dihydropyridinecarboxylic acids and derivatives Pyridinones Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Lactams Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	3-phenylpyridine - Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Dihydropyridine - Pyridinone - Benzenoid - Monocyclic benzene moiety - Hydropyridine - Vinylogous amide - Heteroaromatic compound - Lactam - Carboxylic acid - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - 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
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	2-oxo-5-phenyl-1H-pyridine-3-carboxylic acid
INCHI	InChI=1S/C12H9NO3/c14-11-10(12(15)16)6-9(7-13-11)8-4-2-1-3-5-8/h1-7H,(H,13,14)(H,15,16)
InChIKey	SIHMMTANWQXEHE-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)C2=CNC(=O)C(=C2)C(=O)O
Isomeric SMILES	C1=CC=C(C=C1)C2=CNC(=O)C(=C2)C(=O)O
PubChem CID	10375975
Molecular Weight	215.2

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	215.200 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	215.058 Da
Monoisotopic Mass	215.058 Da
Topological Polar Surface Area	66.400 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	376.000
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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