Product
Supplier
Encyclopedia
Inquiry
Home > Encyclopedia > 5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE

5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE

5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE structure

5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE 

structure
  • CAS No:

    913836-17-6

  • Formula:

    C7H6BrNO3

  • Chemical Name:

    5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE

  • Synonyms:

    METHYL 5-BROMO-2-HYDROXY-4-PYRIDINECARBOXYLATE;METHYL 5-BROMO-2-HYDROXYISONICOTINATE;Methyl 5-Bromo-2-hydroxypyridine-4-carboxylate, 5-Bromo-4-methoxycarbonyl-2(1H)-pyridinone;Methyl 5-bromo-2-hydroxyisonicotinate 98%;4-Pyridinecarboxylic acid, 5-broMo-1,2-dihydro-2-oxo-, Methyl ester;Methyl 5-broMo-2-hydroxypyridine-4-carboxylate;Methyl 5-broMo-2-oxo-1,2-dihydropyridine-4-carboxylate;Methyl 5-bromo-2-hydroxypyridine-4-carboxylate, 5-Bromo-2-hydroxy-4-(methoxycarbonyl)pyridine

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE Basic Attributes

232.03144

230.953094

DTXSID00649554

2933399090

Characteristics

55.4

0.2

1.7±0.1 g/cm3

400.9°C at 760 mmHg

196.3±27.3 °C

1.591

Safety Information

Xi

Irritant

|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|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE Use and Manufacturing

Step A: Step A: methyl 5-bromo-2-oxo-1, 2-dihydropyridine-4-carboxylate-II To a stirred solution of Conc.H2SO4 (50 mL, 0.668 mol) in water (500 mL) was added methyl 2-amino-5-bromoisonicotinate (I, 50 g, 0.226 mol). The resulting clear brown solution was cooled to 0 C. To the mixture was added NaNO2 (50 g, 0.668 mmol) in water (150 mL) drop wise using addition funnel at 0 C. Vigorous effervescence with evolution of N2 gas was observed. The reaction mixture was warmed to room temperature. The reaction mixture was stirred for additional 30 min at room temperature. The solid was filtered, washed with water (3*150 mL) followed by n-hexane (2*100 mL) to yield as a yellow solid. (48.0 g, 93% yield). 1H NMR (DMSO-d6, 400 MHz), delta (ppm): 7.62 (s, 1H), 6.90 (s, 1H), 5.0 (br, 1H), 3.98 (s, 3H). MS (ESI): mass calcd. for C7H7BrN2O2, 232.01; m/z found, 234[M+2H]+.Step B: methyl 5-bromo-1-methyl-2-oxo-1, 2-dihydropyridine-4-carboxylate-III To a stirred solution of

Computed Properties

Molecular Weight:232.03
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:230.95311
Monoisotopic Mass:230.95311
Topological Polar Surface Area:55.4
Heavy Atom Count:12
Complexity:293
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 5-BROMO-4-METHOXYCARBONYL-2(1H)-PYRIDINONE

Scan the QR Code to Share

Feedback & Suggestions
Send Message

Thank you for your feedback. If you require further assistance, please contact us by email at info@echemi.com or call us at +86-532-55729510.