| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| E192689-250mg |
250mg |
现货  |
| |
| E192689-1g |
1g |
现货 |
|
| 英文别名 | Ethyl 4-(4-fluorophenyl)-2,4-dioxobutanoate | 31686-94-9 | ethyl 3-(4-fluorobenzoyl)pyruvate | Ethyl 4-[4-fluorophenyl]-2,4-dioxobutyrate | Ethyl4-(4-fluorophenyl)-2,4-dioxobutanoate | SCHEMBL1739390 | DTXSID90344400 | MFCD02672449 | AKOS000210885 | DS-17462 | CS-0112624 | A18 |
|---|---|
| 规格或纯度 | ≥98% |
| 英文名称 | Ethyl 4-(4-fluorophenyl)-2,4-dioxobutanoate |
| 运输条件 | 常规运输 |
| PubChem SID | 504759439 |
|---|---|
| IUPAC Name | ethyl 4-(4-fluorophenyl)-2,4-dioxobutanoate |
| INCHI | InChI=1S/C12H11FO4/c1-2-17-12(16)11(15)7-10(14)8-3-5-9(13)6-4-8/h3-6H,2,7H2,1H3 |
| InChi Key | LVLZSYCLOPEBSR-UHFFFAOYSA-N |
| Canonical SMILES | CCOC(=O)C(=O)CC(=O)C1=CC=C(C=C1)F |
| Isomeric SMILES | CCOC(=O)C(=O)CC(=O)C1=CC=C(C=C1)F |
| PubChem CID | 596593 |
| 分子量 | 238.21 |
| 分子量 | 238.210 g/mol |
|---|---|
| XLogP3 | 2.000 |
| 氢键供体数Hydrogen Bond Donor Count | 0 |
| 氢键受体数Hydrogen Bond Acceptor Count | 5 |
| 可旋转键计数Rotatable Bond Count | 6 |
| 精确质量Exact Mass | 238.064 Da |
| 单同位素质量Monoisotopic Mass | 238.064 Da |
| 拓扑极表面积Topological Polar Surface Area | 60.400 Ų |
| 重原子数Heavy Atom Count | 17 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 306.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 0 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
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