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Home > Encyclopedia > Diethyl 2,6-pyridinedicarboxylate

Diethyl 2,6-pyridinedicarboxylate

Diethyl 2,6-pyridinedicarboxylate structure

Diethyl 2,6-pyridinedicarboxylate 

structure
  • CAS No:

    15658-60-3

  • Formula:

    C11H13NO4

  • Chemical Name:

    Diethyl 2,6-pyridinedicarboxylate

  • Synonyms:

    2,6-Pyridinedicarboxylic acid,2,6-diethyl ester;2,6-Pyridinedicarboxylic acid,diethyl ester;Diethyl 2,6-pyridinedicarboxylate;Diethyl dipicolinate;Dipicolinic acid diethyl ester;2,6-Bis(ethoxycarbonyl)pyridine;NSC 78907;2,6-Dicarbethoxypyridine;2,6-Diethyl pyridine-2,6-dicarboxylate

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

Yellow to red crystalline powder

Diethyl 2,6-pyridinedicarboxylate Basic Attributes

223.23

223.23

605-063-3

NS92Z2IS34

78907

DTXSID50166100

29333990

Characteristics

65.5

2

1.165±0.06 g/cm3(Predicted)

28 °C

143-145 °C @ Press: 1 Torr

163.9±22.3 °C

1.509

5.43E-05mmHg at 25°C

Safety Information

36/37/38

26-36/37/39

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

Diethyl 2,6-pyridinedicarboxylate Use and Manufacturing

Thionyl chloride (360 mg, 3 mmol) was added dropwise to a solution of pyridine-2, 6-dicarboxylate (170 mg, 1 mmol) (2) in EtOH (5 mL) at -20 60 g (359.02 mmol) of pyridine-2, 6-dicarboxylic acid and 250 mL (3446. 54 mmol) of S0C12 were added to a 1000 mL round bottom flask and mixed, After refluxing for 8 h, S0C12 was distilled off, and then 300 mL (5140.76 mmol) of absolute ethanol was added dropwise under ice-cooling. The mixture was stirred at room temperature for 8 hours and then concentrated to dryness. The residue was washed with 300 mL of water and then treated with potassium carbonate Adjusted to pH 7 and then extracted three times with 150 mL of methylene chloride. The organic phases were combined and the organic phase was washed with 200 mL of saturated brine, And dried over anhydrous sodium sulfate, filtered and dried to give 66 g (295. 66 mmol) of the yellowish crystalline solid, pyridine-2, 6-dicarboxylic acid diethyl ester, in 82.35percent yield;A general synthetic procedure is as follows. Pyridine-2, 6-dicarboxylic acid (1, 1.5 g, 8.98 mmol) was mixed with 24 mL of SOCl

Computed Properties

Molecular Weight:223.22
XLogP3:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:223.08445790
Monoisotopic Mass:223.08445790
Topological Polar Surface Area:65.5
Heavy Atom Count:16
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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