6-methyl-2,3-pyridinedicarboxylic acid

Product Information

Molecular Formula:
C8H7NO4
Molecular Weight:
181.15
Description
6-methyl-2,3-pyridinedicarboxylic acid is a constituent of paramount significance in the biomedical. Widely harnessed in the formulation of pharmaceuticals aimed at a wide range of afflictions, encompassing cancer and neurodegenerative maladies, its intricate therapeutic modalities elevate it to an auspicious contender. Through the manipulation of particular biological phenomena, it holds immense promise as a therapeutic agent, poised to combat these ailments with precision.
Synonyms
6-METHYL PYRIDINE 2,3 DICARBOXYLIC ACID; 6-METHYL-2,3-PYRIDINEDICARBOXYLIC ACID; 6-METHYL-2,3-PYRIDINECARBOXYLICACID; 6-Methyl-2,3-pyridinedicarboxylic acid, HPLC 97%; 2,3-PYRIDINEDICARBOXYLIC ACID, 6-METHYL- (6CI,9CI); 6-METHYLQUINOLIC ACID
IUPAC Name
6-methylpyridine-2,3-dicarboxylic acid
Canonical SMILES
CC1=NC(=C(C=C1)C(=O)O)C(=O)O
InChI
InChI=1S/C8H7NO4/c1-4-2-3-5(7(10)11)6(9-4)8(12)13/h2-3H,1H3,(H,10,11)(H,12,13)
InChI Key
PHQBKLKZIXCRIX-UHFFFAOYSA-N
Boiling Point
414.8ºC at 760mmHg
Melting Point
170ºC (dec.)(lit.)
Flash Point
Not applicable
Purity
95%
Density
1.46g/cm3
Appearance
Crystalline powder

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338

Computed Properties

XLogP3
0.6
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
2
Exact Mass
181.03750770 g/mol
Monoisotopic Mass
181.03750770 g/mol
Topological Polar Surface Area
87.5Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
228
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-112409249-A 6-methylpyridine-2, 3-dicarboxylic acid zinc complex and preparation method thereof 2020-10-28
CN-110818628-A Preparation method of nitrogen-containing aromatic dicarboxylic acid 2019-11-08
CN-110818628-B Preparation method of nitrogen-containing aromatic dicarboxylic acid 2019-11-08
US-2021115300-A1 Composition and method for silicon oxide and carbon doped silicon oxide cmp 2019-10-22
WO-2021081162-A1 Composition and method for silicon oxide and carbon doped silicon oxide cmp 2019-10-22
TW-202122523-A Composition and method for silicon oxide and carbon doped silicon oxide cmp 2019-10-22
CN-109232405-A 6- picoline -2,3- dicarboxylic acids nickel complex and preparation method thereof 2018-09-13
WO-2019104398-A1 Cleansing compositions 2017-11-29
BR-112020010785-A2 cleaning composition and method for cleaning hair 2017-11-29
AU-2018326734-A1 Substituted 2-azabicyclo(3.1.1)heptane and 2-azabicyclo(3.2.1)octane derivatives as orexin receptor antagonists 2017-09-01

Literatures

PMID Publication Date Title Journal
22495333 2012-05-28 New monoacylhydrazidate-coordinated Mn2+ and Pb2+ compounds Dalton transactions (Cambridge, England : 2003)
21189019 2011-01-27 Identifying chelators for metalloprotein inhibitors using a fragment-based approach Journal of medicinal chemistry
20533466 2010-07-19 The equilibrium between the octahedral and square pyramidal form and the influence of an axial ligand on the molecular properties of V(IV)O complexes: a spectroscopic and DFT study Chemistry (Weinheim an der Bergstrasse, Germany)
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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