499-81-0,MFCD00006393
Catalog No.:AA0033H2

499-81-0 | 3,5-Pyridinedicarboxylic acid

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Purity
Availability
Price(USD)
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25g
98% (contains <5%H2O)
in stock  
$12.00   $8.00
- +
500g
98% (contains <5%H2O)
in stock  
$203.00   $142.00
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  • Technical Information
  • Properties
  • Literature
  • Application
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0033H2
Chemical Name:
3,5-Pyridinedicarboxylic acid
CAS Number:
499-81-0
Molecular Formula:
C7H5NO4
Molecular Weight:
167.1189
MDL Number:
MFCD00006393
SMILES:
OC(=O)c1cncc(c1)C(=O)O
NSC Number:
6497
Properties
Properties
 
BP:
463.7°C at 760 mmHg  
Form:
Solid  
MP:
>300 °C(lit.)  
Refractive Index:
1.6280 (estimate)  
Solubility:
1.0g/l  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.1  

Literature

Title: 2D-1D structural phase transformation of Co(II) 3,5-pyridinedicarboxylate frameworks with chromotropism.

Journal: Dalton transactions (Cambridge, England : 2003) 20120921

Title: Poly[diaqua-(μ(5)-pyridine-3,5-dicarboxyl-ato)strontium].

Journal: Acta crystallographica. Section E, Structure reports online 20120601

Title: catena-Poly[[[aqua-(5-carb-oxy-pyridine-3-carboxyl-ato-κN)copper(I)]-μ-4,4'-bipyridine-κN:N'] monohydrate].

Journal: Acta crystallographica. Section E, Structure reports online 20120201

Title: Photochemical hydrogen production from water using three-dimensional Zn-Pd metal-organic frameworks.

Journal: Journal of nanoscience and nanotechnology 20120101

Title: Giant deuteron migration during the isosymmetric phase transition in deuterated 3,5-pyridinedicarboxylic acid.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20111223

Title: Phonon-driven proton transfer in 3,5-pyridine dicarboxylic acid studied by 2H, 14N, and 17O nuclear quadrupole resonance.

Journal: The journal of physical chemistry. A 20111027

Title: Poly[[[μ(2)-1,1'-(butane-1,4-di-yl)bis-(1H-imidazole)-κN:N](μ(2)-2,6-di-methyl-pyridine-3,5-dicarboxyl-ato-κO:O)zinc] dihydrate].

Journal: Acta crystallographica. Section E, Structure reports online 20111001

Title: 4,4'-Bipyridine-pyridine-3,5-dicarb-oxy-lic acid (3/4).

Journal: Acta crystallographica. Section E, Structure reports online 20110801

Title: catena-Poly[[[tetra-aqua-cobalt(II)]-μ-4,4'-bipyridine-κN:N'] pyridine-3,5-dicarboxyl-ate trihydrate].

Journal: Acta crystallographica. Section E, Structure reports online 20110701

Title: 3,5-Dicarboxypyridinium fluoride.

Journal: Acta crystallographica. Section E, Structure reports online 20110701

Title: Poly[triaqua-tris-(μ(4)-pyridine-3,5-dicarboxyl-ato)dicerium(III)].

Journal: Acta crystallographica. Section E, Structure reports online 20110201

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Discrimination of small gas molecules through adsorption: reverse selectivity for hydrogen in a flexible metal-organic framework.

Journal: Inorganic chemistry 20091102

Title: [H2O2 oxidation of 1,4-dihydropyridines over Mg2+ ion exchanged clinoptilolite and solventless solid state acid decomposition of ester to 3,5-pyridinedicarboxylic acid].

Journal: Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20091001

Title: Poly[diaqua-(μ(2)-5-carboxy-pyridine-3-carboxyl-ato-κN:O)hemi(μ(2)-oxalato-κO,O:O,O)(μ(4)-pyridine-3,5-dicarboxyl-ato-κN:O:O:O)silver(I)terbium(III)].

Journal: Acta crystallographica. Section E, Structure reports online 20091001

Title: Poly[diaqua-(μ(3)-pyridine-3,5-dicarboxyl-ato-κN:O:O)copper(II)].

Journal: Acta crystallographica. Section E, Structure reports online 20090501

Title: Inhibitor scaffolds for 2-oxoglutarate-dependent histone lysine demethylases.

Journal: Journal of medicinal chemistry 20081127

Title: Coordination cages of rhodium and iridium as exoreceptors for alkali metal ions.

Journal: Inorganic chemistry 20080721

Title: Binding enhancements of nicotinic acid to water-soluble zinc porphyrins based on triple attractions of coordination, Coulomb, and CH-pi interactions.

Journal: Chemical & pharmaceutical bulletin 20080701

Title: Poly[triaqua-μ(4)-pyridine-3,5-dicarboxyl-ato-barium(II)].

Journal: Acta crystallographica. Section E, Structure reports online 20080201

Title: Poly[tetra-aqua-μ(3)-pyridine-3,5-dicarboxyl-ato-strontium(II)].

Journal: Acta crystallographica. Section E, Structure reports online 20080201

Title: Addition-elimination in the reaction of alpha-hydroxyalkyl radicals with 3,5-pyridinedicarboxylic acid and nicotinic acid: example of inner sphere organic electron transfer.

Journal: The journal of physical chemistry. A 20071115

Title: Sensitive femtosecond coherent anti-Stokes Raman spectroscopy discrimination between dipicolinic acid and dinicotinic acid.

Journal: Optics letters 20061101

Title: Triggered ligand release coupled to framework rearrangement: generating crystalline porous coordination materials.

Journal: Inorganic chemistry 20061030

Title: Phonon driven proton transfer in crystals with short strong hydrogen bonds.

Journal: The Journal of chemical physics 20060621

Title: Influence of water content on the self-assembly of metal-organic frameworks based on pyridine-3,5-dicarboxylate.

Journal: Inorganic chemistry 20060320

Title: Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid.

Journal: Acta crystallographica. Section B, Structural science 20051201

Title: Terminal co-ligand directed synthesis of a neutral, non-interpenetrated (10,3)-a metal-organic framework.

Journal: Chemical communications (Cambridge, England) 20050428

Title: Potentiometric sensor for dipicolinic acid.

Journal: Biosensors & bioelectronics 20050315

Title: Self-assembly of polymer and sheet structures in palladium(II) complexes containing carboxylic acid substituents.

Journal: Inorganic chemistry 20021007

Title: A molybdenum-containing dehydrogenase catalyzing an unusual 2-hydroxylation of nicotinic acid.

Journal: Applied microbiology and biotechnology 20020401

Application
3,5-Pyridinedicarboxylic acid acts as a competitive inhibitor of butyrobetaine hydroxylase.
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SDS
Tags:499-81-0 Molecular Formula|499-81-0 MDL|499-81-0 SMILES|499-81-0 3,5-Pyridinedicarboxylic acid
Catalog No.: AA0033H2
499-81-0,MFCD00006393
499-81-0 | 3,5-Pyridinedicarboxylic acid
Pack Size: 25g
Purity: 98% (contains <5%H2O)
in stock
$12.00 $8.00
Pack Size: 500g
Purity: 98% (contains <5%H2O)
in stock
$203.00 $142.00
Quantity
- +
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Technical Information
Catalog Number: AA0033H2
Chemical Name: 3,5-Pyridinedicarboxylic acid
CAS Number: 499-81-0
Molecular Formula: C7H5NO4
Molecular Weight: 167.1189
MDL Number: MFCD00006393
SMILES: OC(=O)c1cncc(c1)C(=O)O
NSC Number: 6497
Properties
BP: 463.7°C at 760 mmHg  
Form: Solid  
MP: >300 °C(lit.)  
Refractive Index: 1.6280 (estimate)  
Solubility: 1.0g/l  
Storage: Keep in dry area;Room Temperature;  
Complexity: 184  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.1  
Literature fold

Title: 2D-1D structural phase transformation of Co(II) 3,5-pyridinedicarboxylate frameworks with chromotropism.

Journal: Dalton transactions (Cambridge, England : 2003)20120921

Title: Poly[diaqua-(μ(5)-pyridine-3,5-dicarboxyl-ato)strontium].

Journal: Acta crystallographica. Section E, Structure reports online20120601

Title: catena-Poly[[[aqua-(5-carb-oxy-pyridine-3-carboxyl-ato-κN)copper(I)]-μ-4,4'-bipyridine-κN:N'] monohydrate].

Journal: Acta crystallographica. Section E, Structure reports online20120201

Title: Photochemical hydrogen production from water using three-dimensional Zn-Pd metal-organic frameworks.

Journal: Journal of nanoscience and nanotechnology20120101

Title: Giant deuteron migration during the isosymmetric phase transition in deuterated 3,5-pyridinedicarboxylic acid.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)20111223

Title: Phonon-driven proton transfer in 3,5-pyridine dicarboxylic acid studied by 2H, 14N, and 17O nuclear quadrupole resonance.

Journal: The journal of physical chemistry. A20111027

Title: Poly[[[μ(2)-1,1'-(butane-1,4-di-yl)bis-(1H-imidazole)-κN:N](μ(2)-2,6-di-methyl-pyridine-3,5-dicarboxyl-ato-κO:O)zinc] dihydrate].

Journal: Acta crystallographica. Section E, Structure reports online20111001

Title: 4,4'-Bipyridine-pyridine-3,5-dicarb-oxy-lic acid (3/4).

Journal: Acta crystallographica. Section E, Structure reports online20110801

Title: catena-Poly[[[tetra-aqua-cobalt(II)]-μ-4,4'-bipyridine-κN:N'] pyridine-3,5-dicarboxyl-ate trihydrate].

Journal: Acta crystallographica. Section E, Structure reports online20110701

Title: 3,5-Dicarboxypyridinium fluoride.

Journal: Acta crystallographica. Section E, Structure reports online20110701

Title: Poly[triaqua-tris-(μ(4)-pyridine-3,5-dicarboxyl-ato)dicerium(III)].

Journal: Acta crystallographica. Section E, Structure reports online20110201

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Discrimination of small gas molecules through adsorption: reverse selectivity for hydrogen in a flexible metal-organic framework.

Journal: Inorganic chemistry20091102

Title: [H2O2 oxidation of 1,4-dihydropyridines over Mg2+ ion exchanged clinoptilolite and solventless solid state acid decomposition of ester to 3,5-pyridinedicarboxylic acid].

Journal: Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan20091001

Title: Poly[diaqua-(μ(2)-5-carboxy-pyridine-3-carboxyl-ato-κN:O)hemi(μ(2)-oxalato-κO,O:O,O)(μ(4)-pyridine-3,5-dicarboxyl-ato-κN:O:O:O)silver(I)terbium(III)].

Journal: Acta crystallographica. Section E, Structure reports online20091001

Title: Poly[diaqua-(μ(3)-pyridine-3,5-dicarboxyl-ato-κN:O:O)copper(II)].

Journal: Acta crystallographica. Section E, Structure reports online20090501

Title: Inhibitor scaffolds for 2-oxoglutarate-dependent histone lysine demethylases.

Journal: Journal of medicinal chemistry20081127

Title: Coordination cages of rhodium and iridium as exoreceptors for alkali metal ions.

Journal: Inorganic chemistry20080721

Title: Binding enhancements of nicotinic acid to water-soluble zinc porphyrins based on triple attractions of coordination, Coulomb, and CH-pi interactions.

Journal: Chemical & pharmaceutical bulletin20080701

Title: Poly[triaqua-μ(4)-pyridine-3,5-dicarboxyl-ato-barium(II)].

Journal: Acta crystallographica. Section E, Structure reports online20080201

Title: Poly[tetra-aqua-μ(3)-pyridine-3,5-dicarboxyl-ato-strontium(II)].

Journal: Acta crystallographica. Section E, Structure reports online20080201

Title: Addition-elimination in the reaction of alpha-hydroxyalkyl radicals with 3,5-pyridinedicarboxylic acid and nicotinic acid: example of inner sphere organic electron transfer.

Journal: The journal of physical chemistry. A20071115

Title: Sensitive femtosecond coherent anti-Stokes Raman spectroscopy discrimination between dipicolinic acid and dinicotinic acid.

Journal: Optics letters20061101

Title: Triggered ligand release coupled to framework rearrangement: generating crystalline porous coordination materials.

Journal: Inorganic chemistry20061030

Title: Phonon driven proton transfer in crystals with short strong hydrogen bonds.

Journal: The Journal of chemical physics20060621

Title: Influence of water content on the self-assembly of metal-organic frameworks based on pyridine-3,5-dicarboxylate.

Journal: Inorganic chemistry20060320

Title: Variable-temperature neutron diffraction studies of the short, strong hydrogen bonds in the crystal structure of pyridine-3,5-dicarboxylic acid.

Journal: Acta crystallographica. Section B, Structural science20051201

Title: Terminal co-ligand directed synthesis of a neutral, non-interpenetrated (10,3)-a metal-organic framework.

Journal: Chemical communications (Cambridge, England)20050428

Title: Potentiometric sensor for dipicolinic acid.

Journal: Biosensors & bioelectronics20050315

Title: Self-assembly of polymer and sheet structures in palladium(II) complexes containing carboxylic acid substituents.

Journal: Inorganic chemistry20021007

Title: A molybdenum-containing dehydrogenase catalyzing an unusual 2-hydroxylation of nicotinic acid.

Journal: Applied microbiology and biotechnology20020401

Application fold
3,5-Pyridinedicarboxylic acid acts as a competitive inhibitor of butyrobetaine hydroxylase.
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