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3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester

3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester structure

CAS No:
4591-55-3
Formula:
C9H9NO4
Chemical Name:
3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester
Synonyms:
3,5-Pyridinedicarboxylic acid,3,5-dimethyl ester;3,5-Pyridinedicarboxylic acid,dimethyl ester;Dimethyl 3,5-pyridinedicarboxylate;3,5-Bismethoxycarbonylpyridine;3,5-Di(methoxycarbonyl)pyridine;NSC 403260;3,5-Dimethyl pyridine-3,5-dicarboxylate;26471-68-1

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Description

Pale Yellow Solid

3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester Basic Attributes

Molecular Weight：

195.17

Exact Mass：

195.17

EC Number：

224-981-1

NSC Number：

403260

DSSTox ID：

DTXSID60196655

Characteristics

PSA：

65.5

XLogP3：

0.6

Density：

1.232g/cm3

Melting Point：

84-85 °C

Boiling Point：

267.6°C at 760 mmHg

Flash Point：

115.6±21.8 °C

Refractive Index：

1.516

Safety Information

Precautionary statement(s)：

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

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester Use and Manufacturing

2, 6-Pyridine dicarboxylic acid (5.00 g, 29.92 mmol) was dissolved in MeOH (100 ml) and concentrated sulfuric acid (2 ml) was slowly added thereto and refluxed for 18 hours. After the reaction was completed, the solvent was removed under reduced pressure, and the mixture was extracted with sodium bicarbonate and dichloromethane. The dichloromethane layer was washed with a saturated sodium chloride aqueous solution to obtain 5.5 g (94percent) of compound l14) [Step 1]

Computed Properties

Molecular Weight:195.17
XLogP3:0.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:195.05315777
Monoisotopic Mass:195.05315777
Topological Polar Surface Area:65.5
Heavy Atom Count:14
Complexity:207
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

3,5-Pyridinedicarboxylic acid, 3,5-dimethyl ester

SDS

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