5-Nitro-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid methyl ester

CAS

222970-61-8

Catalog Number

ACM222970618

Category

Other Products

Molecular Weight

198.13

Molecular Formula

C₇H₆N₂O₅

MSDS COA Spec Sheet

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Specification

Synonyms

Methyl 6-hydroxy-5-nitronicotinate, 222970-61-8, methyl 5-nitro-6-oxo-1,6-dihydropyridine-3-carboxylate, ACMC-209fum, AC1Q43QI, CTK4E9138, MolPort-004-779-333, ANW-24812, ZINC08699911, AKOS006230705, AKOS008126038, AG-E-62943, MCULE-2295982122, AK-86603, KB-54674, EN300-39314, 2-Hydroxy-5-(methoxycarbonyl)-3-nitropyridine, Methyl 6-hydroxy-5-nitropyridine-3-carboxylate, T6260515, I14-25523

IUPAC Name

methyl 5-nitro-6-oxo-1H-pyridine-3-carboxylate

Canonical SMILES

COC(=O)C1=CNC(=O)C(=C1)[N+](=O)[O-]

InChI Key

ILGFGEIQCLRIBI-UHFFFAOYSA-N

Boiling Point

365.4ºC at 760mmHg

Flash Point

174.8ºC

Density

1.49g/cm³

Exact Mass

198.02800

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

67-56-1
6635-31-0

222970-61-8

Reference: [1]Current Patent Assignee: LYCERA CORPORATION - WO2016/138335, 2016, A1
Location in patent: Paragraph 00373
[2]Berrie et al.
[Journal of the Chemical Society, 1951, p. 2590,2593]

Downstream Synthesis Route 1

222970-61-8

222970-60-7

Reference: [1]Linn, James A.; Gerritz, Samuel W.; Handlon, Anthony L.; Hyman, Clifton E.; Heyer, Dennis
[Tetrahedron Letters, 1999, vol. 40, # 12, p. 2227 - 2230]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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