2,6-Pyridinedicarboxylic acid

Product Information

Molecular Formula:
C7H5NO4
Molecular Weight:
167.12
Description
An amphoteric polar metabolite produced by many bacterial and fungal species.
Synonyms
Dipicolinic Acid
IUPAC Name
pyridine-2,6-dicarboxylic acid
Canonical SMILES
C1=CC(=NC(=C1)C(=O)O)C(=O)O
InChI
InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-5(8-4)7(11)12/h1-3H,(H,9,10)(H,11,12)
InChI Key
WJJMNDUMQPNECX-UHFFFAOYSA-N
Boiling Point
463.7 °C at 760 mmHg
Melting Point
248-250 °C (dec.)(lit.)
Flash Point
188°C
Purity
> 95 % by HPLC
Density
1.551 g/cm3
Solubility
Soluble in ethanol, methanol, DMF, DMSO
Appearance
White solid
Application
Permitted for use as an inert ingredient in non-food pesticide products.
Storage
Store at -20 °C
Refractive Index
1.62
Stability
Stable under normal temperatures and pressures.
LogP
0.47800
Vapor Pressure
2.13E-09mmHg at 25°C

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Signal Word
Danger

Computed Properties

XLogP3
0.6
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
2
Exact Mass
167.02185764 g/mol
Monoisotopic Mass
167.02185764 g/mol
Topological Polar Surface Area
87.5Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
184
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-114106301-A High-performance liquid crystal high-molecular polymer and preparation method and application thereof 2021-12-22
CN-114133404-A Preparation method and application of copper-based coordination polymer with mixed valence states 2021-12-15
CN-114133993-A Prenatal treatment composition, prenatal treatment fluid and using method of prenatal treatment fluid 2021-12-03
CN-114134323-A Process method for separating copper and manganese and application thereof 2021-11-30
CN-113979933-A Preparation method of 4-chloropyridine-2, 6-diformyl chloride 2021-11-29
CN-113975901-A Preparation method of graphene composite antiviral powder and antibacterial and antiviral air filter material 2021-11-25
CN-113999802-A Paenibacillus cucurbitae strain capable of expressing high-activity lactase 2021-11-23
CN-113861688-A Low-dielectric polyphenylene sulfide composite material and preparation method thereof 2021-10-28
CN-113817158-A Preparation method of high-temperature-resistant nylon resin 2021-10-26
CN-114044913-A Metal-organic framework material and preparation method thereof 2021-10-25

Literatures

PMID Publication Date Title Journal
31678113 2020-01-05 Pyridine-2,3-dicarboxylate, quinolinic acid, induces 1N4R Tau amyloid aggregation in vitro: Another evidence for the detrimental effect of the inescapable endogenous neurotoxin Chemico-biological interactions
26639393 2016-04-01 Model-guided identification of a therapeutic strategy to reduce hyperammonemia in liver diseases Journal of hepatology
23070516 2012-12-07 Rational design of a fluorescent receptor for the recognition of anthrax biomarker dipicolinate The Analyst
23088412 2012-11-01 Multifactorial resistance of Bacillus subtilis spores to high-energy proton radiation: role of spore structural components and the homologous recombination and non-homologous end joining DNA repair pathways Astrobiology
22776375 2012-10-01 Effects of wet heat treatment on the germination of individual spores of Clostridium perfringens Journal of applied microbiology
22836165 2012-09-21 High efficiency co-sensitized solar cell based on luminescent lanthanide complexes with pyridine-2,6-dicarboxylic acid ligands Dalton transactions (Cambridge, England : 2003)
22623031 2012-09-07 Synthesis, crystal structure of α-Keggin heteropolymolybdates with pyridine-2,6-dicarboxylate based frameworks, and associated RhB photocatalytic degradation and 2D-IR COS tests Dalton transactions (Cambridge, England : 2003)
22706206 2012-09-07 Keggin polyoxoanion supported organic-inorganic trinuclear lutetium cluster, {Na(H2O)3[Lu(pydc)(H2O)3]3}[SiW12O40]·26.5H2O Dalton transactions (Cambridge, England : 2003)
22882262 2012-09-01 Evaluation of ROSCO Neo-Sensitabs for phenotypic detection and subgrouping of ESBL-, AmpC- and carbapenemase-producing Enterobacteriaceae APMIS : acta pathologica, microbiologica, et immunologica Scandinavica
22862681 2012-08-22 Anion complexation and transport by isophthalamide and dipicolinamide derivatives: DNA plasmid transformation in E. coli Journal of the American Chemical Society
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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