4-Chloro-1-(4-Fluorophenyl)Butan-1-One 4-氯-4’-氟苯丁酮
CAS 3874-54-2 MFCD00001007
化学结构图
SMILES: O=C(CCCCl)c1ccc(F)cc1
化学属性
| Mol. Formula | C10H10ClFO |
|---|---|
| Mol. Weight | 200.64 |
| Density | 1.22 g/mL at 25 °C(lit.) |
| Refractive index | 1.5240 to 1.5280 |
| Flash Point | >113.00°C |
| TSCA | Yes |
| Boiling Point | 136-142°C at 6 mmHg |
| Melting Point | 5-6°C |
| Solubility | 0.38 G/L (20 ºC) |
| Stability | 对空气敏感 |
别名和识别编码
| Chemical Name | 4-Chloro-1-(4-Fluorophenyl)Butan-1-One |
|---|---|
| CAS Number | 3874-54-2 |
| Synonym | 4-Chloro-1-(4-fluorophenyl)butan-1-one {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-1-(4-fluorophenyl)butan |
| MDL Number | MFCD00001007 |
| PubChem Substance ID | 19750 |
| EC Number | 223-395-3 |
| Reaxys-RN | 608741 |
| Beilstein Registry Number | 608741 |
| Chemical Name Translation | 4-氯-4’-氟苯丁酮 |
| LabNetwork Molecule ID | LN00204859 |
| Canonical SMILES | O=C(C1=CC=C(F)C=C1)CCCCl |
| InChI | InChI=1S/C10H10ClFO/c11-7-1-2-10(13)8-3-5-9(12)6-4-8/h3-6H,1-2,7H2 |
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分类
- Aryl Fluorinated Building Blocks, Building Blocks, C10, C8-C12, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Ketones, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
- {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C10, C8-C12, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Ketones, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
相关文献及参考
- FT-IR 2 (2), 2401:D / FT-IR 1 (2), 27:B / FT-NMR 1 (2), 835:C / IR-Spectra (3), 863:G / IR-Spectra (2), 756:A / NMR-Reference 2 (2), 30:B / RegBook 1 (2), 1639:F / Structure Index 1 , 257:B:6
安全信息
- R22 Harmful if swallowed 吞咽有害
- S36 Wear suitable protective clothing 穿戴适当的防护服；
- S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
- H227 Combustible liquid 可燃液体
- H302 Harmful if swallowed 吞食有害
- H315 Causes skin irritation 会刺激皮肤
- H317 May cause an allergic skin reaction 可能导致皮肤过敏
- H319 Causes serious eye irritation 严重刺激眼睛
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- H341 Suspected of causing genetic defects 怀疑导致遗传性缺陷
- H401 Toxictoaquaticlife 对水生生物有毒。
- H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
- P201 Obtain special instructions before use. 使用前获取专门指示。
- P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前，切勿操作。
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
- P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
- P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
- P273 Avoid release to the environment. 避免释放到环境中。
- P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
- P281 Use personal protective equipment as required. 使用所需的个人防护装备。
- P301+P312
- P302+P352
- P304+P340
- P305+P351+P338
- P308+P313
- P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
- P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
- P330 Rinse mouth. 漱口
- P332+P313
- P333+P313
- P337+P313
- P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
- P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
- P370+P378
- P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
- P403+P233
- P403+P235
- P405 Store locked up. 上锁保管。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
其他信息
- 水中溶解度: 0.38 g/L water (20°C) ，溶于甲醇、乙醇、异丙醇、N,N-DMF, 丙酮和二氯甲烷。
- 4-氯-4'-氟苯丁酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 C1294 4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone 25G 291元 2011/04/16 C1294 4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone 250G 1330元 2010/06/21 109235000 4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone 97% 500 GR 3295元
- 4-氯-4'-氟苯丁酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C1294 4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone 25G 281元 2014/06/02 C1294 4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone 250G 1300元 2010/06/21 109235000 4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone 97% 500 GR 3295元
- Alfa Aesar:4-氯-4'-氟苯丁酮,97% 4-Chloro-4'-fluorobutyrophenone, 96%(3874-54-2)
- 用途一:用作医药中间体，有机合成
- Sigma Aldrich:3874-54-2(sigmaaldrich)
- TCI Shanghai:4-氯-4'-氟苯丁酮 4-Chloro-4'-fluorobutyrophenone,>;95.0%(GC)(3874-54-2)
- Hazard Note:Irritant
- MOL 文件:3874-54-2.mol
- Acros Organics:4-Chloro-4'-fluorobutyrophenone, 97%(3874-54-2)
- MSDS 信息:4-Chloro-1-(4-fluorophenyl)-1-butanone(3874-54-2).msds
