| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| M179391-1g |
1g |
期货  |
|
| 英文别名 | Methyl 3-bromo-4H-thieno[3,2-b]pyrrole-5-carboxylate | 1105187-36-7 | 3-Bromo-4H-thieno[3,2-b]pyrrole-5-carboxylic acid methyl ester | MFCD11973824 | SC2771 | Methyl3-bromo-4H-thieno[3,2-b]pyrrole-5-carboxylate | SCHEMBL1847169 | DTXSID80656847 | FZMSYEZKZFUHPQ-UHFFFAOYS |
|---|---|
| 规格或纯度 | 95% |
| 英文名称 | Methyl 3-bromo-4h-thieno[3,2-b]pyrrole-5-carboxylate |
| 储存温度 | 室温 |
| 运输条件 | 常规运输 |
| IUPAC Name | methyl 3-bromo-4H-thieno[3,2-b]pyrrole-5-carboxylate |
|---|---|
| INCHI | InChI=1S/C8H6BrNO2S/c1-12-8(11)5-2-6-7(10-5)4(9)3-13-6/h2-3,10H,1H3 |
| InChi Key | FZMSYEZKZFUHPQ-UHFFFAOYSA-N |
| Canonical SMILES | COC(=O)C1=CC2=C(N1)C(=CS2)Br |
| Isomeric SMILES | COC(=O)C1=CC2=C(N1)C(=CS2)Br |
| 分子量 | 260.1 |
| Reaxy-Rn | 21512297 |
| Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21512297&ln= |
| 分子量 | 260.110 g/mol |
|---|---|
| XLogP3 | 2.700 |
| 氢键供体数Hydrogen Bond Donor Count | 1 |
| 氢键受体数Hydrogen Bond Acceptor Count | 3 |
| 可旋转键计数Rotatable Bond Count | 2 |
| 精确质量Exact Mass | 258.93 Da |
| 单同位素质量Monoisotopic Mass | 258.93 Da |
| 拓扑极表面积Topological Polar Surface Area | 70.300 Ų |
| 重原子数Heavy Atom Count | 13 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 226.000 |
| 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 |
| 信号词 | Warning |
|---|---|
| 危险声明 |
H302: 吞食有害 H317: 可能引起皮肤过敏反应 |
| 预防措施声明 |
P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 |
| Reaxy-Rn | 21512297 |
| Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21512297&ln= |
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