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Methyl 2-ethynylisonicotinate

Product Name
Methyl 2-ethynylisonicotinate
CAS No.
1256810-92-0
Chemical Name
Methyl 2-ethynylisonicotinate
Synonyms
Methyl 2-ethynylisonicotinate;Methyl 2-ethynyl-4-pyridinecarboxylate;Methyl 2-ethynylisonicotinate - [M51179];4-Pyridinecarboxylic acid, 2-ethynyl-, methyl ester
CBNumber
CB92716894
Molecular Formula
C9H7NO2
Formula Weight
161.16
MOL File
1256810-92-0.mol
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Methyl 2-ethynylisonicotinate Property

Boiling point:
271.1±25.0 °C(Predicted)
Density 
1.17±0.1 g/cm3(Predicted)
storage temp. 
under inert gas (nitrogen or Argon) at 2-8°C
pka
0.15±0.20(Predicted)
Appearance
Off-white to light yellow Solid
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

Synthonix
Product number
M51179
Product name
Methyl2-ethynylisonicotinate
Purity
98%
Packaging
100mg
Price
$110
Updated
2021/12/16
Synthonix
Product number
M51179
Product name
Methyl2-ethynylisonicotinate
Purity
98%
Packaging
250mg
Price
$170
Updated
2021/12/16
Activate Scientific
Product number
AS44930
Product name
Methyl 2-ethynylisonicotinate
Purity
98%
Packaging
100mg
Price
$188
Updated
2021/12/16
Activate Scientific
Product number
AS44930
Product name
Methyl 2-ethynylisonicotinate
Purity
98%
Packaging
250mg
Price
$355
Updated
2021/12/16
Synthonix
Product number
M51179
Product name
Methyl2-ethynylisonicotinate
Purity
98%
Packaging
1g
Price
$420
Updated
2021/12/16
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Methyl 2-ethynylisonicotinate Chemical Properties,Usage,Production

Synthesis

499193-51-0

1256810-92-0

Methyl 2-((trimethylsilyl)ethynyl)isonicotinate (8.00 g, 34.2 mmol) was used as the raw material, which was dissolved in THF (150 mL), and TBAF (1.0 M solution of THF, 51.4 mL, 51.4 mmol) was added slowly at 0°C. The reaction mixture was gradually warmed to room temperature and stirred continuously for 1 hour. After the reaction was completed, the reaction mixture was diluted with ethyl acetate (50 mL) and washed with 10% NaHCO3 solution (50 mL). The organic layer was separated, dried with anhydrous MgSO4 and concentrated under reduced pressure to give a dark brown to black residue. The residue was loaded on silica gel and purified by column chromatography (SiO2, eluent: 0-20% ethyl acetate/petroleum ether, 40-60°C) to afford the target product methyl 2-alkynylisonicotinate (4.5 g, 81% yield) as a yellow solid.1H NMR (400 MHz, CDCl3) δ 8.73 (dd, J = 5.1, 0.9 Hz, 1H), 8.01 (dd, J = 5.1, 0.9 Hz, 1H), 8.01 (dd, J = 5.1, 0.9 Hz). 8.01 (dd, J = 1.5, 0.9 Hz, 1H), 7.80 (dd, J = 5.1, 1.6 Hz, 1H), 3.95 (s, 3H), 3.22 (s, 1H).

References

[1] Patent: WO2012/110773, 2012, A1. Location in patent: Page/Page column 145; 146
[2] Patent: WO2014/27199, 2014, A1. Location in patent: Page/Page column 148

Methyl 2-ethynylisonicotinate Preparation Products And Raw materials

Raw materials

Preparation Products

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Methyl 2-ethynylisonicotinate Suppliers

Shanghai YuanYe Biotechnology Co., Ltd.
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1256810-92-0, Methyl 2-ethynylisonicotinateRelated Search:


  • Methyl 2-ethynylisonicotinate
  • 4-Pyridinecarboxylic acid, 2-ethynyl-, methyl ester
  • Methyl 2-ethynyl-4-pyridinecarboxylate
  • Methyl 2-ethynylisonicotinate - [M51179]
  • 1256810-92-0