3-Nitrophenacylbromide
- CAS No.
- 2227-64-7
- Chemical Name:
- 3-Nitrophenacylbromide
- Synonyms
- 2-BroMo-3&priMe;AKOS BBS-00003963;Alpha-Bromo-3'-nitroacetophenone;3-Nitrophenacylbromid;LABOTEST-BB LT00233190;3-NITROPHENACYL BROMIDE;M-NITROPHENACYL BROMIDE;3'-NITROPHENACYL BROMIDE;a-Bromo-3itroacetophenone
- CBNumber:
- CB2319971
- Molecular Formula:
- C8H6BrNO3
- Molecular Weight:
- 244.04
- MDL Number:
- MFCD00024512
- MOL File:
- 2227-64-7.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Melting point | 90-96 °C(lit.) |
|---|---|
| Boiling point | 288.6±15.0 °C(Predicted) |
| Density | 1.8033 (rough estimate) |
| refractive index | 1.6090 (estimate) |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | Soluble in methanol. |
| form | Crystalline Powder |
| color | Beige-orange to yellow-green |
| BRN | 610594 |
| InChI | 1S/C8H6BrNO3/c9-5-8(11)6-2-1-3-7(4-6)10(12)13/h1-4H,5H2 |
| InChIKey | GZHPNIQBPGUSSX-UHFFFAOYSA-N |
| SMILES | [O-][N+](=O)c1cccc(c1)C(=O)CBr |
| CAS DataBase Reference | 2227-64-7(CAS DataBase Reference) |
| NIST Chemistry Reference | 2-Bromo-3'-nitroacetophenone(2227-64-7) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) | ![]() GHS05 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H314 | |||||||||
| Precautionary statements | P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363 | |||||||||
| PPE | Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges | |||||||||
| Hazard Codes | C | |||||||||
| Risk Statements | 34 | |||||||||
| Safety Statements | 26-27-28-36/37/39-45 | |||||||||
| RIDADR | UN 3261 8/PG 2 | |||||||||
| WGK Germany | 3 | |||||||||
| HazardClass | 8 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29147000 | |||||||||
| Storage Class | 8A - Combustible corrosive hazardous materials | |||||||||
| Hazard Classifications | Skin Corr. 1B | |||||||||
| NFPA 704 |
|
3-Nitrophenacylbromide price More Price(55)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | 344214 | 2-Bromo-3′-nitroacetophenone 97% | 2227-64-7 | 5g | $64.7 | 2026-04-30 | Buy |
| Sigma-Aldrich | 344214 | 2-Bromo-3′-nitroacetophenone 97% | 2227-64-7 | 25g | $141 | 2023-06-20 | Buy |
| TCI Chemical | B2855 | 2-Bromo-3'-nitroacetophenone | 2227-64-7 | 5G | $20 | 2026-04-30 | Buy |
| TCI Chemical | B2855 | 2-Bromo-3'-nitroacetophenone | 2227-64-7 | 25G | $55 | 2026-04-30 | Buy |
| Usbiological | 264234 | a-Bromo-3'-nitroacetophenone Asreported | 2227-64-7 | 25g | $420 | 2026-06-03 | Buy |
3-Nitrophenacylbromide Chemical Properties, Uses, Production
Chemical Properties
beige-orange to yellow-green crystalline powder
Uses
2-Bromo-3′-nitroacetophenone may be used in the preparation of 2-bromo-3′-nitroacetophenone. It may be used in the preparation of 2-hydroxy-ethyl-1-[(3-nitro-phenyl)-2-oxoethyl]-piperidinium bromide.
General Description
Debromination of 2-bromo-3′-nitroacetophenone in various solvents has been reported.
Synthesis
121-89-1
2227-64-7
The general procedure for the synthesis of 2-bromo-3'-nitroacetophenone from m-nitroacetophenone is as follows: preparation of 2-bromo-1-(3-nitrophenyl)acetophenone (2a-1). Aluminum chloride (0.16 g, 1.20 mmol) was added to a suspension of commercially available 3-nitroacetophenone (4.82 g, 29.19 mmol) in anhydrous ether (25 mL). The reaction mixture was cooled to 0 °C, followed by the slow dropwise addition of bromine (1.50 mL, 29.19 mmol). The reaction mixture was stirred at room temperature for 1 h until complete conversion of the feedstock (monitored by 1H NMR) and the reaction was quenched quickly to avoid dibromide formation. After addition of water (30 mL), the mixture was extracted with ether (3 x 30 mL) and dried over anhydrous magnesium sulfate to afford compound 2a-1 as a yellow-brown solid (5.73 g, 97% yield).1H NMR (CDCl3, 200 MHz): δ 4.50 (s, 2H, H1), 7.73 (t, J = 8.0 Hz, 1H, H7), 8.31 ( ddd, J = 7.8, 1.7, 1.1 Hz, 1H, H8), 8.43 (ddd, J = 8.2, 2.3, 1.1 Hz, 1H, H6), 8.76 (t, J = 1.9 Hz, 1H, H4).13C NMR (CDCl3, 200 MHz): δ 30.4, 123.9, 128.2, 130.4, 134.6, 135.2, 148.6, 189.5. MS-ESI (m/z): [M + H]+ = 244.9.
References
[1] Journal of Medicinal Chemistry, 2016, vol. 59, # 18, p. 8276 - 8292
[2] Patent: WO2017/17004, 2017, A1. Location in patent: Page/Page column 17
[3] Bioorganic and Medicinal Chemistry Letters, 2017, vol. 27, # 10, p. 2192 - 2196
[4] Tetrahedron Letters, 2011, vol. 52, # 31, p. 4026 - 4029
[5] Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2009, vol. 48, # 10, p. 1424 - 1430
3-Nitrophenacylbromide Preparation Products And Raw materials
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Shandong Binchen Chemical Co.,Ltd | 13837799094 18351216136 | 3846935277@qq.com | China | 2631 | 58 |
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
| Meryer (Shanghai) Chemical Technology Co., Ltd. | 4006356688 18621169109 | market03@meryer.com | China | 40202 | 62 |
| 3B Pharmachem (Wuhan) International Co.,Ltd. | 18930552037 | 3bsc@sina.com | China | 15813 | 69 |
| Alfa Aesar | 400-6106006 | saleschina@alfa-asia.com | China | 30103 | 84 |
| TAIYUAN RHF CO.,LTD. | +86 351 7031519 | sales@RHFChem.com | China | 2334 | 56 |
| TCI (Shanghai) Development Co., Ltd. | 021-67121386 | Sales-CN@TCIchemicals.com | China | 24512 | 81 |
| Energy Chemical | 400-0056266 | sales8178@energy-chemical.com | China | 44850 | 61 |
| Capot Chemical Co., Ltd | +86 (0) 571 85 58 67 18 | China | 18187 | 66 | |
| Shanghai Hanhong Scientific Co.,Ltd. | 021-54306202 13764082696 | info@hanhongsci.com | China | 42917 | 64 |
View Latest Price from 3-Nitrophenacylbromide manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
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2026-09-02 | 3-Nitrophenacylbromide
2227-64-7
|
$5.00 | 1KG | 99% | Henan Fengda Chemical Co., Ltd | ||
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2026-06-30 | 3-Nitrophenacylbromide
2227-64-7
|
1KG | 99% | 1000kgs | Shaanxi Dideu New Materials Co. Ltd | ||
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2023-10-22 | 3-Nitrophenacylbromide
2227-64-7
|
1drums | 99%min. | 10tons | Shanghai Xinchem Co., Ltd. |
-

- 3-Nitrophenacylbromide
2227-64-7
- $5.00
- 99%
- Henan Fengda Chemical Co., Ltd
-

- 3-Nitrophenacylbromide
2227-64-7
- $0.00
- 99%
- Shaanxi Dideu New Materials Co. Ltd
-

- 3-Nitrophenacylbromide
2227-64-7
- 99%min.
- Shanghai Xinchem Co., Ltd.
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