ChemicalBook--->CAS DataBase List--->89937-77-9

89937-77-9

89937-77-9 Structure

89937-77-9 Structure
IdentificationBack Directory
[Name]

Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate
[CAS]

89937-77-9
[Synonyms]

NSC 132887
Methyl 2-hydroxypyridine-...
4-Methoxycarbonyl-2-pyridone
methyl 2-hydroxyisonicotinate
methyl 2-oxo-1H-pyridine-4-carboxylate
Methyl 2-hydroxypyridine-4-carboxylate
1,2-dihydro-2-oxopyridine-4-carboxylate
Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate
Methyl 2-oxo-1,2-dihydropyridine-4-carboxylate
Methyl 2-oxo-1,2-dihydro-4-pyridinecarboxylate
Methyl1,2-dihydro-2-oxopyridine-4-carboxylate98%
Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate 98%
4-Pyridinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester
4-Pyridinecarboxylicacid,1,2-dihydro-2-oxo-,methylester(9CI)
Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate ISO 9001:2015 REACH
Methyl 2-hydroxypyridine-4-carboxylate, 1,2-Dihydro-4-(methoxycarbonyl)-2-oxopyridine
[Molecular Formula]

C7H7NO3
[MDL Number]

MFCD09258780
[MOL File]

89937-77-9.mol
[Molecular Weight]

153.135
Chemical PropertiesBack Directory
[Melting point ]

211-212 °C
[Boiling point ]

342.4±42.0 °C(Predicted)
[density ]

1.263±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

solid
[pka]

11.02±0.10(Predicted)
[color ]

White to off-white
[InChI]

InChI=1S/C7H7NO3/c1-11-7(10)5-2-3-8-6(9)4-5/h2-4H,1H3,(H,8,9)
[InChIKey]

DATHOCDTDDUESC-UHFFFAOYSA-N
[SMILES]

C1(=O)NC=CC(C(OC)=O)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[RIDADR ]

UN2811
[Hazard Note ]

Irritant
[HS Code ]

2933399990
Hazard InformationBack Directory
[Uses]

Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate is an ester derivative, mainly used as a pharmaceutical intermediate.
[Synthesis]

The synthesis method of Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate is as follows: Dissolve 10 g (0.066 mol) of m-nitrobenzaldehyde and 11 g (0.067 mol) of ethyl chloroacetate in 60 ml of benzene, and add 1 ml of piperidine. 1 ml of glacial acetic acid, heated in a water bath, and the water generated in the reaction was continuously removed with a Dean-start water separator. After refluxing for 3h, the benzene was evaporated, 20ml of ether was added to the residue, frozen, crystallized, suction filtered, and dried to give 16.2g of methyl 2-hydroxypyridine-4-carboxylate, yield 82%, mp 92 -96°C.

[References]

[1] Patent: WO2010/104830, 2010, A1. Location in patent: Page/Page column 70-71
[2] Patent: WO2013/105676, 2013, A1. Location in patent: Page/Page column 220; 221
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 1,2-dihydro-2-oxopyridine-4-carboxylate(89937-77-9)1HNMR
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