2-Methyl-1,3-cyclopentanedione 2-甲基-1,3-环戊二酮
规格: 97%
CAS:
765-69-5
产品编号: H58626
MDL:
MFCD00001406
品牌: INFI
1.3-二酮系列产品
杂环化合物是有机化合物中数量最庞大的一个类别，约占总数的三分之二以上，是多种化学类药物的合成砌块，除此杂环化合物之外还应用于纳米材料、超导材料、农用化学品等的合成。而1, 3-二酮类化合物作为杂环化合物一类重要的合成子, 它的α位活泼亚甲基可通过手性催化剂、金属催化剂或廉价易得的碱，催化形成新的碳-碳键、碳-杂键等，从而高效合成一系列杂环化合物。例如：1,3-二酮化合物经过一系列串联反应，合成吡唑羧酸类杂环化合物[1]，这类分子具有KEAP1抑制活性，可以破坏NRF2和KEAP1蛋白之间相互作用，治疗慢性氧化应激疾病。
(a) DMF-DMA, TsOH, 130 °C, 15 min microwave；(b) 2-bromopyridine-6-hydrazine or 3-bromophenyl hydrazine, DIPEA, EtOH;
(c) 3-bromo-N,N-dimethylbenzamide, Pd(PPh3)4, Na2CO3, dioxane/H2O, 100 °C, 1 h then NaOH or LiOH.
图一 Journal of Medicinal Chemistry, 2021, 64 , 15949-15972.
研峰科技拥有完整配套的研发生产设备，通过前期大量的工艺研究、公司规范有效的管控流程及智能管理系统，实现了1.3-二酮系列产品稳定量产，质量稳定，满足客户要求，还可以根据客户的需要进行定制。详细产品情况请致电客服人员（400-106-2016）进行咨询。
| Chemical Name | 2-Methylcyclopentane-1,3-dione |
|---|---|
| CAS Number | 765-69-5 |
| Alfabeta Name | METHYLCYCLOPENTANEDIONE 213---, |
| MDL Number | MFCD00001406 |
| EC Number | 212-153-2 |
| Beilstein Registry Number | 1237255 |
| PubChem Substance ID | 13005 |
| Synonym | 2-Methylcyclopentane-1,3-dione {LY} 2-Methylcyclopentane-1,3-dione {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclopentane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} |
| Chemical Name Translation | 2-甲基-1,3-环戊二酮 |
| Reaxys-RN | 1237255 |
| InChIKey | HXZILEQYFQYQCE-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00222075 |
| InChI | InChI=1S/C6H8O2/c1-4-5(7)2-3-6(4)8/h4H,2-3H2,1H3 |
| Canonical SMILES | CC1C(CCC1=O)=O |
| Warnings | IRRITANT |
|---|---|
| WGK Germany | 3 |
| Personal Protective Equipment | Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter |
| Hazard Codes | Xi |
| Safety Statements | |
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| Precautionary statements | |
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| Hazard statements | |
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| Storage condition | 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { |
化学属性
| Mol. Formula | C6H8O2 |
|---|---|
| Mol. Weight | 112.13 |
| Melting Point | 212-215°C |
| TSCA | No |
| Appearance | 白色结晶体。 |
| Boiling Point | 218°C at 760 mmHg |
| Density | 1.0 |
*以上化合物性质及应用等信息仅供参考
