3,5-二甲基苯甲酰氯 3,5-二甲基苯甲酰氯
CAS 6613-44-1 MFCD02313742
化学结构图
SMILES: Cc1cc(C)cc(C(=O)Cl)c1
化学属性
| Mol. Formula | C9H9ClO |
|---|---|
| Mol. Weight | 168.62 |
| Density | 1.14 |
| TSCA | Yes |
| Boiling Point | |
| Refractive index | 1.5440 to 1.5480 |
| Stability | 对湿度敏感 |
| Appearance | 本品为无色或淡黄色液体，b.p.109.5℃/1.33kpa，遇水分解成相应的酸，溶于苯、甲苯。 |
| Melting Point | No Data Available |
别名和识别编码
| Chemical Name | 3,5-二甲基苯甲酰氯 |
|---|---|
| MDL Number | MFCD02313742 |
| CAS Number | 6613-44-1 |
| Synonym | 3,5-Dimethylbenzoyl chloride {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} |
| EC Number | 413-010-9 |
| Reaxys-RN | 636724 |
| Beilstein Registry Number | 9(4)1806 |
| PubChem Substance ID | 87559623 |
| Chemical Name Translation | 3,5-二甲基苯甲酰氯 |
| InChIKey | ZJIOBDJEKDUUCI-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00010185 |
| Canonical SMILES | O=C(Cl)C1=CC(C)=CC(C)=C1 |
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分类
- {SNA} Acid Halides, Building Blocks, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks
- {Chemicalbook} 农药中间体: 杀虫剂中间体: 其他杀虫剂
相关文献及参考
- Beilstein:9(4)1806
安全信息
- S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
- S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
- S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
- R34 Causes burns 会导致灼伤
- R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- 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。
- P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P234 Keep only in original container. 只保留在原来的容器中。
- P305+P351+P338+P310
- P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P301+P330+P331+P310
- P303+P361+P353
- P304+P340
- P305+P351+P338
- H290 May be corrosive to metals 可能腐蚀金属。
GHS Symbol
其他信息
- 3,5-二甲基苯甲酰氯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D3550 3,5-二甲基苯甲酰氯 3,5-Dimethylbenzoyl Chloride 5G 364元 2014/06/02 D3550 3,5-二甲基苯甲酰氯 3,5-Dimethylbenzoyl Chloride 25G 1050元
- TCI Shanghai:3,5-二甲基苯甲酰氯 3,5-Dimethylbenzoyl Chloride,>;97.0%(GC)(T)(6613-44-1)
- 上游原料:间羟基苯甲酸 --> 3,5-二甲基苯甲酸
- 方法一:其制备方法是在反应瓶中加入甲苯和3，5-二甲基苯甲酸，搅拌，升温到55℃，开始滴加氯化亚砜，滴加完毕，升温到80℃，反应5h，降温，减压蒸去甲苯，继续减压蒸馏得产品。
- MOL 文件:6613-44-1.mol
- 用途一:用作有机合成中间体
- 用途四:有机中间体。
- 用途三:3，5-二甲基苯甲酰氯是杀虫剂虫酰肼、甲氧虫酰肼的中间体。
- 用途二:广泛应用于农药、医药和感光材料等领域的中间体。
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