5-Bromo-3-fluoro-2-pyridinecarbonitrile
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5-Bromo-3-fluoro-2-pyridinecarbonitrile
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CAS No:
886373-28-0
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Formula:
C6H2BrFN2
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Chemical Name:
5-Bromo-3-fluoro-2-pyridinecarbonitrile
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Synonyms:
2-Pyridinecarbonitrile,5-bromo-3-fluoro-;5-Bromo-3-fluoro-2-pyridinecarbonitrile;5-Bromo-3-fluoropyridine-2-carbonitrile;5-Bromo-3-fluoropicolinonitrile
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CAS No:
5-Bromo-3-fluoro-2-pyridinecarbonitrile Basic Attributes
200.9958832
201.00
1533716-785-6
DTXSID40657830
2933399090
Safety Information
IRRITANT
UN 2811 6.1 / PGIII
3
22-38-41
26-39
Xn
P280-P301 + P310-P305 + P351 + P338
H302
|Danger|H301 (97.62%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P280, P301+P310, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P362, P405, and P501|Aggregated GHS information provided by 42 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-Bromo-3-fluoro-2-pyridinecarbonitrile Use and Manufacturing
Step C: 5-Bromo-3-fluoro-pyridine-2-carbonitrile To a mixture of HStep C: 5-Bromo-3-fluoro-pyridine-2-carbonitrileTo a mixture of HTetrabutylammonium fluoride (26.3 ml, 26.3 mmol, 1M in THF) was charged to a round bottom flask and cooled to -40°C. This was treated with sulfuric acid (0.04 ml, 0.074 g, 0.750 mmol). It was then treated with DMF (18 ml) until the suspension became homogenous. To this mixture was added slowly a solution of 5-bromo-3- nitropicolinonitrile (2.0 g, 8.77 mmol) dissolved in DMF (32 ml). Once the addition was complete the reaction was allowed to stir at -40°C for 90 minutes and at roomtemperature for another 1 hour. The reaction was then quenched with 2 N HC1 (20 ml), then diluted with HStir amixture of S-bromo-S-fluoro-pyridine^-carboxylic acid amide (0.375 mg, 1.71 mmol) and NaCl (0.120 g, 2.05 mmol) in CH
Computed Properties
Molecular Weight:201.00
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Exact Mass:199.93854
Monoisotopic Mass:199.93854
Topological Polar Surface Area:36.7
Heavy Atom Count:10
Complexity:164
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-Bromo-3-fluoro-2-pyridinecarbonitrile
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